cyclohexyl propanol
 
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IUPAC name :2-cyclohexylpropan-1-ol
InChI :InChI=1/C9H18O/c1-8(7-10)9-5-3-2-4-6-9/h8-10H,2-7H2,1H3
InChIKey :IRIVQXLOJHCXIE-UHFFFAOYAS
SMILES :CC(CO)C1CCCCC1
(EINECS) number :226-632-9
cas number :5442-00-2
molar refractivity :43.06 ± 0.3 cm3
parachor :373.8 ± 6.0 cm3
index of refraction :1.464 ± 0.02
surface tension :32.9 ± 3.0 dyne/cm
density :0.911 ± 0.06 g/cm3
polarizability :17.07 ± 0.5 10-24cm3
xlogp : 3.00
molecular weight : 142.2386200
formula :C9 H18 O
BioActivity Analysis :83335
 
 
export tariff code :unspecified
fda reg :unspecified
 

organoleptics :
odor type :floral
odor strength :medium
odor description :
at 100.00 %.  
floral mint green geranium muguet balsam
substantivity :12  Hour(s)

properties :
appearence :colorless to pale yellow clear liquid
assay : 96.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 211.00 to 212.00 °C. @ 760.00 mm Hg
logp : 2.75

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) : 136.00  °F.  TCC  ( 57.78 °C. )
recommendation for cyclohexyl propanol usage levels up to :
  20.0000 % in the fragrance concentrate.
recommendation for cyclohexyl propanol usage levels up to :
 not for flavor use.

safety links :
 
 
(EINECS) number :226-632-9
chemidplus :005442002
EPA Substance Registry Services :5442-00-2
NLM Chemical Carcinogenesis Research Information System :5442-00-2
NLM Developmental and Reproductive Toxicity :5442-00-2
NLM Env. Mutagen Info. Center :5442-00-2
NLM GENetic TOXicology :5442-00-2
dtp/nci :20786
EPI System :view

other :

references :
pubchem :656514
NIST Chemistry WebBook :377976281
synonyms :
2-cyclohexyl propan-1-ol
 cyclohexyl propanol
2-cyclohexyl-1-propanol
beta-methyl cyclohexane ethanol

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) blends with :
 amyl benzoate
 benzophenone
alpha-butyl cinnamaldehyde
 cananga oil
 cinnamyl formate
laevo-citronellol
 citronellyl acetate
 citronellyl acetone
 citronellyl ethoxalate
 citronellyl isobutyrate
 citronellyl oxyacetaldehyde
 citronellyl propionate
(E)-citronellyl tiglate
 cumin carbinol
 cyclamen homoaldehyde
 cyclohexyl crotonate
 cyclohexyl salicylate
2-cyclopentyl cyclopentanone
(E,Z)-2,4-decadien-1-al
2-decalinol
3-decanone
(Z)-4-decen-1-al
2-decen-1-al
 dihydrogeranyl linalool
 dihydrorose oxide
 dimethyl benzyl carbinol
 dimethyl benzyl carbinyl butyrate
6,8-dimethyl-2-nonanol
 diphenyl methane
 diphenyl oxide
 earthy indane
 ethyl linalyl acetal
 ethyl methyl-para-tolyl glycidate
 ethyl salicylate
(E,E)-farnesol
 floral butanal
 floral methanol
 floral pyran
 floral pyranol
 floral undecenone
 geranium cyclohexane
 geranium dihydropyran
 geranium nitrile
 geranium oil
 geranium pyran
 geranium thiazole
 geranyl acetone
 geranyl hexanoate
 geranyl isobutyrate
 geranyl nonanoate
 geranyl tiglate
 grapefruit pentanol
 hawthorn ethanol
(Z)-3-hexen-1-yl benzoate
(Z)-3-hexen-1-yl salicylate
alpha-hexyl cinnamaldehyde
beta-ionol
pseudoionone
 ivy dioxolane
 jasimia
 jasmin cyclopentanol
 leerall
 lilyall
 lilyall / methyl anthranilate schiff's base
 magnolia cyclohexanol
 methoxycitronellal
 methyl citronellate
para-methyl hydratropaldehyde
 methyl octine carbonate
 methyl salicylate
 mimosa absolute
 muguet butanal
 muguet butanol
 muguet carboxaldehyde
 muguet ethanol
 muguet nitrile
 muguet propanol
 muguet shiseol
 muguet undecadienal
 musk acetate
 myrmac aldehyde
 neroli oil
 nerolidol
 nonyl benzoate
 octanal dimethyl acetal
 peony acetonitrile
 phenethyl pivalate
 phenyl acetaldehyde digeranyl acetal
 phenyl glycol diacetate
2-phenyl propionaldehyde ethylene glycol acetal
3-phenyl propyl propionate
1-phenyl-1-propanol
4-phenyl-3-buten-2-ol
(Z,E)-phytol
 rhodinyl propionate
 rose butanoate
(Z)-rose oxide
laevo-rose oxide

(odor and/or flavor) used in :
 floral
 green
 herbal
 mint

natural occurrence in :
not found in nature



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Html Last modified 11/23/2008