EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

aldehydic nitrile
hypo-lem (IFF)

Supplier Sponsors

Name:3,7-dimethyloctanenitrile
CAS Number: 40188-41-8Picture of molecule3D/inchi
ECHA ELINCS - REACH Pre-Reg:403-620-3
Nikkaji Web:J422.415I
XlogP3-AA:3.70 (est)
Molecular Weight:153.26843000
Formula:C10 H19 N
NMR Predictor:Predict (works with chrome or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Boiling Point: 223.00 to 224.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.098000 mm/Hg @ 25.00 °C. (est)
Flash Point: 190.00 °F. TCC ( 87.78 °C. )
logP (o/w): 3.680
Soluble in:
 alcohol
 water, slightly
 water, 31.28 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 alcoholic lotion
 antiperspirant
 bleach
 deo stick
 detergent
 fabric softener
 shampoo
 soap
 
Organoleptic Properties:
Odor Type: citrus
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
Substantivity:24 hour(s) at 100.00 %
citrus aldehydic lemon fatty metallic
Odor Description:at 10.00 % in dipropylene glycol. citrus aldehydic lemon fatty metallic
Luebke, William tgsc, (2004)
Odor sample from: International Flavors & Fragrances Inc.
Odor and/or flavor descriptions from others (if found).
IFF
Hypo-LEM
Odor Description:Citrus, aldehydic, fatty waxy with some metallic facets
Citrus,Fatty, Metallic, Lemon. Hot, Zesty, Citrus (Dried Lemon/Orange Peel, Palmarosa note. To give a rich natural body to all fragrances employing the natural cologne moiety.
Taytonn
Hypo-Lem
Odor Description:Aldehydic/ Aldehyde, Citrus, Fatty, Metallic/ Metal, Palmarosa, Zest/ Zesty
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
BASF
Dihydrocitronellylnitrile
Odor: Citrus, lemon, aldehydic-waxy, slightly floral-rosy
Use: A very useful substitute for Geranonitrile: citrus, lemon, aldehydic, providing floral and rosy notes with a natural effect. Combines perfectly with Citronellylnitrile. This product is of ultimate stability in all kinds of application, it is an universal tool for functional perfumery but also very valuable in fine fragrances (up to 10%)
Ernesto Ventós
DIHYDROCITRONELLYLNITRILE BASF
Odor: CITRUS,LEMON,ALDEHYDIC-WAXY,ROSY
Ernesto Ventós
HYPO-LEM IFF
Odor: CITRUS, FATTY, METALLIC, LEMON
Global Essence
Dihydro Citronellyl Nitrile
IFF
Hypo-LEM
Odor: Citrus, aldehydic, fatty waxy with some metallic facets
Use: Citrus,Fatty, Metallic, Lemon. Hot, Zesty, Citrus (Dried Lemon/Orange Peel, Palmarosa note. To give a rich natural body to all fragrances employing the natural cologne moiety.
Penta International
3,7-DIMETHYL OCTANENITRILE
Taytonn
Hypo-Lem
Odor: Aldehydic/ Aldehyde, Citrus, Fatty, Metallic/ Metal, Palmarosa, Zest/ Zesty
The John D. Walsh Company
Hypo-Lem
Vigon International
Dihydro Citronellyl Nitrile (Hypo-Lem)
Odor: Citrus, lemon, aldehydic-waxy, slightly floral-rosy
 
Safety Information:
European information :
Most important hazard(s):
Xi - Irritant
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
Recommendation for aldehydic nitrile usage levels up to:
  30.0000 % in the fragrance concentrate.
 
Recommendation for aldehydic nitrile flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):40188-41-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :170284
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
3,7-dimethyloctanenitrile
Chemidplus:0040188418
 
References:
Leffingwell:Chirality or Article
 3,7-dimethyloctanenitrile
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:40188-41-8
Pubchem (cid):170284
Pubchem (sid):135125208
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2926.90.0000
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
acetyl nonyryl
FL/FR
aldehydic fragrance
FR
citrus carbaldehyde
FR
decanal (aldehyde C-10)
FL/FR
dodecanal (aldehyde C-12 lauric)
FL/FR
geranyl oxyacetaldehyde
FR
muguet undecadienal
FR
nonanal (aldehyde C-9)
FL/FR
octanal (aldehyde C-8)
FL/FR
2-
tridecenal
FL/FR
N-/i-
undecanal
FR
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
citrus
acetaldehyde citronellyl methyl acetal
FR
aldenal C-10
FR
bergamot oil bergaptene reduced italy
FL/FR
citral propylene glycol acetal
FL/FR
citronella oil ceylon
FL/FR
citronellyl nitrile
FR
(E)-4-
decenal
FL/FR
dihydromyrcenol
FL/FR
grapefruit oil c.p. california
FL/FR
grapefruit pentanol
FR
lemon oil c.p. california
FL/FR
lemongrass oil
FL/FR
lemongrass oil guatemala
FL/FR
lime oil distilled mexico
FL/FR
litsea cubeba fruit oil
FL/FR
mandarin lemon fagrance
FR
mandarin oil (citrus reticulata var. ponkan)
FL/FR
methyl heptenone
FL/FR
ocimenol
FL/FR
blood
orange oil italy
FL/FR
bitter
orange peel oil brazil
FL/FR
sweet
orange peel oil c.p. brazil
FL/FR
tangerine oil america
FL/FR
tetrahydromyrcenol
FR
trimethyl cyclohexene
FR
verbena oil spain
FL/FR
verbena oil terpeneless
FL/FR
fatty
decanol
FL/FR
floral
alpha-
amyl cinnamaldehyde
FL/FR
alpha-
amyl cinnamaldehyde dimethyl acetal
FL/FR
bois de rose oil brazil
FL/FR
citronellal
FL/FR
citronellol
FL/FR
citronellyl acetate
FL/FR
coriander seed oil
FL/FR
cyclamen aldehyde
FL/FR
9-
decen-1-ol
FL/FR
dimethyl anthranilate
FL/FR
geraniol
FL/FR
geranyl acetate
FL/FR
heliotropin
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
leerall
FR
laevo-
linalool
FL/FR
linalool
FL/FR
muguet butanal
FR
muguet nitrile
FR
muguet octadienol
FR
nerol
FL/FR
petitgrain lemon oil
FL/FR
petitgrain oil paraguay
FL/FR
phenethyl alcohol
FL/FR
tetrahydrolinalool
FL/FR
fruity
gamma-
decalactone
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
(E)-2-
undecenal
FL/FR
green
iso
decanal
FL/FR
diphenyl oxide
FL/FR
green dioxolane
FR
(Z)-3-
hexen-1-yl octanoate
FL/FR
2,4-
ivy carbaldehyde
FL/FR
herbal
canarium luzonicum gum
FL/FR
clary sage oil france
FL/FR
alpha-
dihydroterpineol
FL/FR
lavender absolute bulgaria
FL/FR
linalyl acetate
FL/FR
3-
octyl acetate
FL/FR
musk
(E)-12-
musk decenone
FR
nutty
(+)-(E,S)-
filbertone
FL/FR
spicy
cinnamaldehyde
FL/FR
clove bud oil
FL/FR
iso
eugenol
FL/FR
terpenic
frankincense oil
FL/FR
laevo-
limonene
FL/FR
alpha-
phellandrene
FL/FR
gamma-
terpinene
FL/FR
alpha-
terpineol
FL/FR
waxy
(E)-2-
tridecenal
FL/FR
For Flavor
No flavor group found for these
alpha-
amyl cinnamaldehyde dimethyl acetal
FL/FR
citral propylene glycol acetal
FL/FR
iso
decanal
FL/FR
ocimenol
FL/FR
aldehydic
aldehydic
acetyl nonyryl
FL/FR
nonanal (aldehyde C-9)
FL/FR
octanal (aldehyde C-8)
FL/FR
2-
tridecenal
FL/FR
cherry
heliotropin
FL/FR
citrus
bergamot oil bergaptene reduced italy
FL/FR
citronella oil ceylon
FL/FR
grapefruit oil c.p. california
FL/FR
lemon oil c.p. california
FL/FR
lemongrass oil
FL/FR
lemongrass oil guatemala
FL/FR
lime oil distilled mexico
FL/FR
linalool
FL/FR
laevo-
linalool
FL/FR
litsea cubeba fruit oil
FL/FR
mandarin oil (citrus reticulata var. ponkan)
FL/FR
nerol
FL/FR
blood
orange oil italy
FL/FR
sweet
orange peel oil c.p. brazil
FL/FR
petitgrain lemon oil
FL/FR
tangerine oil america
FL/FR
alpha-
terpineol
FL/FR
verbena oil spain
FL/FR
verbena oil terpeneless
FL/FR
creamy
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
fatty
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
floral
bois de rose oil brazil
FL/FR
citronellal
FL/FR
citronellol
FL/FR
citronellyl acetate
FL/FR
geraniol
FL/FR
linalyl acetate
FL/FR
phenethyl alcohol
FL/FR
tetrahydrolinalool
FL/FR
fruity
gamma-
decalactone
FL/FR
dimethyl anthranilate
FL/FR
bitter
orange peel oil brazil
FL/FR
green
canarium luzonicum gum
FL/FR
cyclamen aldehyde
FL/FR
dihydromyrcenol
FL/FR
diphenyl oxide
FL/FR
geranyl acetate
FL/FR
(Z)-3-
hexen-1-yl octanoate
FL/FR
2,4-
ivy carbaldehyde
FL/FR
methyl heptenone
FL/FR
3-
octyl acetate
FL/FR
herbal
clary sage oil france
FL/FR
coriander seed oil
FL/FR
lavender absolute bulgaria
FL/FR
petitgrain oil paraguay
FL/FR
nutty
(+)-(E,S)-
filbertone
FL/FR
ripe
(E)-4-
decenal
FL/FR
soapy
dodecanal (aldehyde C-12 lauric)
FL/FR
spicy
cinnamaldehyde
FL/FR
clove bud oil
FL/FR
iso
eugenol
FL/FR
terpenic
laevo-
limonene
FL/FR
alpha-
phellandrene
FL/FR
gamma-
terpinene
FL/FR
tropical
alpha-
amyl cinnamaldehyde
FL/FR
waxy
decanal (aldehyde C-10)
FL/FR
decanol
FL/FR
9-
decen-1-ol
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
(E)-2-
tridecenal
FL/FR
(E)-2-
undecenal
FL/FR
woody
alpha-
dihydroterpineol
FL/FR
frankincense oil
FL/FR
 
Potential Uses:
FRaldehydic
FRcitrus
FRcologne
FRlemon
FRorange
FRpalmarosa oil replacer
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 aldehydic nitrile
 dihydro citronellyl nitrile
 dihydrocitronellyl nitrile
 dihydrocitronellylnitrile
3,7-dimethyl octane nitrile
3,7-dimethyl octanenitrile
3,7-dimethyloctanenitrile
 hypo-lem (IFF)
 octanenitrile, 3,7-dimethyl-
 virixal nitrile
 

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