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Product Name  
IngredientAld. C-12 Lauric @ 10% DPGAld. C-14
Cas #112-54-9104-67-6
Master DescriptionAldehyde C-12 LAldehyde C-14
   
Average Price/Lb.1.73.357
Ingredient Price In Formula0.00850.016785
Spot Price3.7422.812
   
Percentage0.50.5
   
7127 Formulas5%21%
Count 3241496
Min 0.010.01
Max 4.533
Average 0.3249074071.842025401
Product 3.606E-2281.7916E-265
Stddev 0.4087885042.982464152
Stddevp 0.408157172.981467172
Var 0.1671080418.895092417
Varp 0.1665922758.889146499
   
CAS NumbersCAS Number:,112-54-9,,CAS Number:,104-67-6,,
Name Onlydodecanal (aldehyde C-12 lauric)gamma-undecalactone (aldehyde C-14 (so-called))
Sds Raw Material Namedodecanal (aldehyde C-12 lauric)   112-54-9.csvgamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv
FormulaFormula:,C12 H24 O,,Formula:,C11 H20 O2,,
Flash PointFlash Point:,214.00Ê¡F.ÊTCCÊ( 101.00 ¡C. ),,Flash Point:,200.00Ê¡F.ÊTCCÊ( 93.33 ¡C. ),,
AppearanceAppearance:,colorless to pale yellow clear liquid (est),,Appearance:,colorless to pale yellow clear oily liquid (est),,
Boiling PointBoiling Point:,185.00Ê¡C. @ 100.00Êmm Hg,,Boiling Point:,164.00ÊtoÊ 166.00Ê¡C. @ 13.00Êmm Hg,,
Match This Columndodecanal (aldehyde C-12 lauric)   112-54-9.csvgamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv
ChemidplusChemidplus:,112549,,Chemidplus:,104676,,
Echa Ec00
Echa EinecsECHA EINECS – REACH Pre-Reg:,203-983-6,,ECHA EINECS – REACH Pre-Reg:,203-225-4,,
Epa SubstanceEPA Substance Registry Services (TSCA):,112-54-9,,EPA Substance Registry Services (TSCA):,104-67-6,,
Epa/Noaa00
Fda UniiFDA UNII:,C42O120SEF,,FDA UNII:,QB1T0AG2YL,,
Fema NumberFEMA Number:,2615ÊÊlauric aldehyde,,FEMA Number:,3091ÊÊgamma-undecalactone,,
FlavorFlavor:Êcitrus, waxy, woody,,,Flavor:Êapricot, coconut, lactonic, aldehydic, fruity, peach,,,
FlavormetFlavornet: ,112-54-9,,Flavornet: ,104-67-6,,
Inchl:InChI: InChI=1/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h12H,2-11H2,1H3,,,InChI: InChI=1/C11H20O2/c1-2-3-4-5-6-7-10-8-9-11(12)13-10/h10H,2-9H2,1H3,,,
Limits In The Fp00
Logp (O/W)logP (o/w):,4.989 (est),,logP (o/w):,2.961 (est),,
Melting PointMelting Point:,3.00ÊtoÊ 8.00Ê¡C. @ 760.00Êmm Hg,,0
Molecular WeightMolecular Weight:,184.32248,,Molecular Weight:,184.2788,,
AssayAssay:,98.00ÊtoÊ100.00Ê%Ê,,Assay:,99.00ÊtoÊ100.00Ê%Ê,,
Cas NumberCAS Number:,112-54-9,,CAS Number:,104-67-6,,
   
Ifra Category 100
Ifra Category 200
Ifra Category 300
Ifra Category 400
Ifra Category 500
Ifra Category 600
Ifra Category 700
Ifra Category 800
Ifra Category 900
Ifra Category 1000
Ifra Category 10A00
Ifra Category 1100
Ifra Category 1200
Ifra Restricted00
Ifra Categories00
Ifra Critical Effects00
Ifra Frag Mat Specs00
   
CategoryCategory: flavor and fragrance agents,,,Category: cosmetic, flavor and fragrance agents,,,
2Nd Cas00
Prohibited00
Prohibited (Likely Duplicate)00
Acid ValueAcid Value:,5.00Êmax.ÊKOH/g,,Acid Value:,5.00Êmax.ÊKOH/g,,
Canada Domestic SubCanada Domestic Sub. List:,112-54-9,,Canada Domestic Sub. List:,104-67-6,,
Coe NumberCoE Number:,99,,CoE Number:,179,,
Cosmetic UsesCosmetic Uses:,masking agents,,Cosmetic Uses:,masking agents,,
Dg Sante Food FlavoringsDG SANTE Food Flavourings:,05.011ÊÊdodecanal,,DG SANTE Food Flavourings:,”10.002ÊÊundecano-1,4-lactone”,,
Do Not Use On00
Fda Internal Number00
Fda MaintermFDA Mainterm:,LAURIC ALDEHYDE,,FDA Mainterm:,GAMMA-UNDECALACTONE,,
Food Chemicals Codex ListedFood Chemicals Codex Listed:,Yes,,Food Chemicals Codex Listed:,Yes,,
Jecfa Food FlavoringJECFA Food Flavoring:,110ÊÊlauric aldehyde,,JECFA Food Flavoring:,233ÊÊgamma-undecalactone,,
KeggKEGG (GenomeNet):,C02278,,KEGG (GenomeNet):,C08571,,
Lab Chemical SafetyLaboratory Chemical Safety Summary :,8194,,Laboratory Chemical Safety Summary :,7714,,
MdlMDL:,MFCD00007017,,MDL:,MFCD00005405,,
Mod Theo Added Maximum00
Std Inchl:Std.InChI: InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h12H,2-11H2,1H3,,,Std.InChI: InChI=1S/C11H20O2/c1-2-3-4-5-6-7-10-8-9-11(12)13-10/h10H,2-9H2,1H3,,,
Blank00
Std InchlkeyStd.InChIKey: HFJRKMMYBMWEAD-UHFFFAOYSA-N,,,Std.InChIKey: PHXATPHONSXBIL-UHFFFAOYSA-N,,,
SmilesSMILES: CCCCCCCCCCCC=O,,,SMILES: CCCCCCCC1CCC(=O)O1,,,
Nikkaji WebNikkaji Web:,J22.116C,,Nikkaji Web:,J1.182G,,
Xlogp3XlogP3-AA:,4.90 (est),,XlogP3:,3.30 (est),,
Specific GravitySpecific Gravity:,0.82600  to  0.83400  @   25.00  °C.,,Specific Gravity:,0.94100  to  0.94700  @   25.00  °C.,,
Pounds Per GallonPounds per Gallon – (est).:,6.873  to   6.940,,Pounds per Gallon – (est).:,7.830  to   7.880,,
Refractive IndexRefractive Index:,1.43300  to  1.43700  @   20.00  °C.,,Refractive Index:,1.44900  to  1.45400  @   20.00  °C.,,
Ph Number00
Vapor PressureVapor Pressure:,0.034000 mm/Hg @ 25.00  °C. (est),,Vapor Pressure:,0.003000 mm/Hg @ 25.00  °C. (est),,
Vapor Density00
UseUse:  Also called Lauric Aldehyde this is another classic aldehydic note and an unsaturated aliphatic aldehyde. The odour is described as soapy, waxy, aldehydic, citrus, orange rindy with floral nuances.,,,Use:  Arctander has quite a bit to say about gamma-Undecalactone, including:  This material is widely used, although in minute amounts, in perfume compositions. In order of frequency in use, it ranks very high among the materials on the perfumer’s shelf. But it is not the kind of material ordinarily sold in drum-lots. However, after the success of a new perfume (type) in the 1950s, the title material had a further increase in popularity, when numerous perfumers used it at unusually high levels along with new non-Nitro musk chemicals, in order to duplicate part of the new note in the successful perfume. The author has yet to see a duplication which sells better than the original (in perfumes), but it must be admitted that Undecalactone drew benefit from this popularity. lt blends excellently with Nonalactone in Gardenia and Tuberose, and in many versions of Lilac bases. It extends the depth of an Orange blossom often too harsh with conventional materials, and it is a frequent component of Honeysuckle, etc. Concentrations far below 1% are effective, and it is at times possible to ruin a fragrance with 0.1 or 0.2% of the title material, just as well as it is possible to double the floral sweetness and depth of another fragrance with that amount of Undecalactone. The material was originally used in Violet perfumes, so popular at the time of discovery of this Lactone (about 1900). But its most important use today is in flavors, primarily in imitation Peach, but also in many fruity types, often as a fixative for the very volatile fruit esters.
   
Organoleptic Data  
Odor DescriptionOdor Description:,”Soapy, waxy, aldehydic, citrus, orange rindy with floral nuances”,,Odor Description:,”Creamy, fatty, fruity, coconut, peach, Iactonic, ketonic and fruity”,,
Odor StrengthOdor Strength:,”high ,”,,Odor Strength:,medium,,
Odor TypeOdor Type:,aldehydic,,Odor Type:,fruity,,
OdorOdor:  A fresh, citrus odor with a ‘natural’ fattiness,,,Odor:   FRUITY, PEACH, SWEET,,,
SubstantivitySubstantivity:,368 hour(s) at 100.00 %,,Substantivity:,338 hour(s) at 100.00 %,,
Taste DescriptionTaste Description:,”Soapy, waxy, citrus, orange mandarin”,,Taste Description:,”Fatty, coconut, creamy, vanilla, nutty, macadamia and peach”,,
   
Refranctive IndexRefractive Index:,1.43300  to  1.43700  @   20.00  °C.,,Refractive Index:,1.44900  to  1.45400  @   20.00  °C.,,
 dodecanal (aldehyde C-12 lauric)   112-54-9.csvgamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv
Formlations/ Prep00
Grade00
 dodecanal (aldehyde C-12 lauric)   112-54-9.csvgamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv
Insoluble/StabilityInsoluble in:,,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:Insoluble in:,,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,water,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,water,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,glycerin,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,glycerin,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 Stability:,,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:Stability:,,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,detergent,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,cream,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,hair care,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,detergent powder,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,non-discoloring in most media,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,hair spray,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 dodecanal (aldehyde C-12 lauric)   112-54-9.csvgamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv
SolubleSoluble in:,,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:Soluble in:,,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,alcohol,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,alkali,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,dipropylene glycol,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,benzyl alcohol,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,fixed oils,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,benzyl benzoate,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,”paraffin oil, cloudy”,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,dipropylene glycol,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,propylene glycol,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,”ethyl alcohol, 1:2 in 70% alcohol”,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,”water, 4.649 mg/L @ 25 °C (est)”,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,”ethyl alcohol, 4.5 vol. 60% alcohol”,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 Insoluble in:,,,,fixed oils,,
 dodecanal (aldehyde C-12 lauric)   112-54-9.csvgamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv
SynonymsSynonyms:,,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:Synonyms:,,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,aldehyde C 12 lauric food grade,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,abriceine,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,”aldehyde C-12 (dodecanal), natural”,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,aldehyde (C-14),,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,aldehyde C-12 lauric,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,aldehyde C-14,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,aldehyde C-12 lauric 1% dpg,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,aldehyde C-14 (gamma-undecalactone),,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,aldehyde C-12 lauric 10% dpg,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,aldehyde C-14 (gamma-undecalactone) natural,,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
 ,aldehyde C-12 lauric natural,,dodecanal (aldehyde C-12 lauric)   112-54-9.csv:,aldehyde C-14 (so-called),,gamma-undecalactone (aldehyde C-14 (so-called))   104-67-6.csv:
   
Intensityhighmedium
Recommended Smellinghigh, recommend smelling in a 10.00 % solution0
Substantivity368338
HoursHour(s)Hour(s)
#1 Odor Master Descriptionsoapy waxy aldehydic citrus green floralfruity peach creamy fatty lactonic apricot ketonic coconut
Full Description Description:  at 10.00 % in dipropylene glycol.  soapy waxy aldehydic citrus green floral Luebke, William tgsc, (1983)   soapy  waxy  aldehydic  citrus  orange rind  floral.     fruity peach creamy fatty lactonic apricot ketonic coconut Luebke, William tgsc, (1981)   creamy  fatty  fruity  coconut  peach  lactonic  ketonic  fruity   Odor Description:  Creamy, fatty, fruity, coconut, peach, Iactonic, ketonic and fruity Mosciano, Gerard P&F 23, No. 2, 43, (1998)   fatty  coconut  creamy  vanilla  nutty  macadamia  peach   Taste Description:  at 30.00 ppm.   Fatty, coconut, creamy, vanilla, nutty, macadamia and peach Mosciano, Gerard P&F 23, No. 2, 43, (1998)
Master DescriptionALDEHYDE C-12L(E)ALDEHYDE C-14 (E)
Primary Cas #112-54-9104-67-6
Odor-Char 1Fatty, woody creamy fatty peach coconut apricot
GradeFCC, Food Grade, Halal, KosherFCC, Follows IFRA Guidelines, Food Grade, Halal, Kosher
Top, Middle, BaseM- AldehydeM- Fruit
T,M,B  Char 200
Bio Data00
Epa Safer Chemical Ingredient ListYellow triangle – The chemical has met Safer Choice Criteria for its functional ingredient-class, but has some hazard profile issues. Specifically, a chemical with this code is not associated with a low level of hazard concern for all human health and environmental endpoints. (See Safer Choice Criteria). While it is a best-in-class chemical and among the safest available for a particular function, the function fulfilled by the chemical should be considered an area for safer chemistry innovation.Green half-circle – The chemical is expected to be of low concern based on experimental and modeled data. Additional data would strengthen our confidence in the chemicals safer status.
   
Solubility Data  
Δd16.0716.36
Δp4.999.19
Δh3.34.22
Δhdon0.10.1
Δhacc3.34.2
Mwt184.3184.3
Density0.8330.945
Mvol221.2195
Area292.73262.64
Ovality1.6551.615
Bpt250.7303.1
Mpt12.1-15.5
Anta7.24037.2893
Antb1845.32063.4
Antc175167.9
Logkow4.982.99
Logs-3.07-3.43
Henry-3.44-3.13
Ri1.4331.448
Δhfus38.1830.41
Δhv@Bpt48.2555.33
Rer0.80.2
Parachor515.5477
Surften29.340.1
Mci6.4146.326
Δhcomb-7.166-6.152
Δhform-448.92-577.17
Δgform-74.7-230.84
R. I.1.4331.433
Sg0.8260.826
Density0.8310.949
Flashpt213.8235.4
Boilingpt185164
Tc712.4798.7
Pc2.142.82
Vc704620
Zc0.2540.263
Ant1T353.6383.6
Logohr-10.16-10.89
Trouton95.294.9
Abr-A00
Abr-B0.450.65
Edmiw0.5760.603
Rd57.5452.15
Ëócp412.2357.7
Log Ëá0.5950.938
Cond.143.3155.4
#Heavy Atom1313
C#1211
H#2420
   
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