alpha-campholenic alcohol
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IUPAC name :2-(2,2,3-trimethyl-1-cyclopent-3-enyl)ethanol
InChI :InChI=1/C10H18O/c1-8-4-5-9(6-7-11)10(8,2)3/h4,9,11H,5-7H2,1-3H3
InChIKey :NPGPPCSBEMHHCR-UHFFFAOYAR
SMILES :CC1=CCC(C1(C)C)CCO
cas number :1901-38-8
(EINECS) number :217-600-5
fema number :3741
jecfa number :970
fl. number :02.114
molar refractivity :47.54 ± 0.3 cm3
parachor :396.0 ± 6.0 cm3
index of refraction :1.460 ± 0.02
surface tension :27.1 ± 3.0 dyne/cm
density :0.889 ± 0.06 g/cm3
polarizability :18.85 ± 0.5 10-24cm3
XlogP : 2.60
XlogP3-AA : 2.10
molecular weight : 154.2493200 (IUPAC)
formula :C10 H18 O
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified

Suppliers :
Nanjing :alpha-campholenic alcohol

organoleptics :
odor type :camphoreous
odor strength :medium
odor description :
at 100.00 %.  
sweet berry camphor

properties :
appearence :colorless clear liquid
assay : 96.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.88200 to 0.89400 @ 20.00 °C.
pounds per gallon - calc. : 7.348 to 7.448
refractive index :1.47000 to 1.47800 @ 20.00 °C.
boiling point : 74.00 °C. @ 0.60 mm Hg
boiling point : 208.00 to 209.00 °C. @ 760.00 mm Hg
flash point : 172.00  °F.  TCC  ( 77.78 °C. )
logP (o/w) : 3.05

safety :
Oral Toxicity(LD50) :
  Gavage-Rat    1000.00  mg/kg
(Levenstein, 1982a)

Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
Maximised Survey-derived Daily Intakes (MSDI-EU) :0.012 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :ND (μg/capita/day)
 

safety references :
European Food Safety Athority(efsa) :Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
EPI System :view
Canada Domestic Sub. List :Yes
 
 
 
 2-(2,2,3-trimethyl-1-cyclopent-3-enyl)ethanol
(EINECS) number :217-600-5
chemidplus :001901388
EPA Substance Registry Services :1901-38-8

references :
 2-(2,2,3-trimethyl-1-cyclopent-3-enyl)ethanol
fl. number :02.114
jecfa number :970
NIST Chemistry WebBook :3021187370
pubchem :197549

other :
VCF-Online: VCF Volatile Compounds in Food
FDA Everything Added to Food in the United States (EAFUS)View
synonyms :
alpha-campholenol
2-(2,2,3-trimethyl cyclopent-3-en-1-yl) ethanol
2,2,3-trimethyl cyclopent-3-ene-1-ethanol
2-(2,2,3-trimethyl-1-cyclopent-3-enyl) ethanol
2-(2,2,3-trimethyl-1-cyclopent-3-enyl)ethanol
2,2,3-trimethyl-3-cyclopentene-1-ethanol

soluble in :
 alcohol
 water, slightly

insoluble in :
 water

(odor and/or flavor) blends with :
 acetaldehyde methyl hexyl acetal
 acetoin butyrate
 acetyl methyl anthranilate
 achillea tenuifolia lam. flower oil iran
 allyl benzoate
 allyl tiglate
1-allyl-2,2,7,7-tetramethyl cycloheptanol
 ambrette seed absolute
delta6-isoambrettolide
isoamyl 2-methyl butyrate
para-anisyl propanal
 armoise oil
 artemisyl ketone
 benzyl butyrate
3-benzyl-4-heptanone
3-benzylidene-2-butanone
 berry hexanoate
 berry pentadienoate
 bisabolene
 blackberry thiophenone
 borneol
dextro-borneol
isoborneol
laevo-borneol
isobornyl acetate
isobornyl formate
 bornyl isobutyrate
(-)-bornyl isovalerate
isobornyl isovalerate
isobornyl methyl ether
isobornyl propionate
 bornyl valerate
 buchu leaf oil
 buchu mercaptan
 butyl anthranilate
isobutyl anthranilate
isobutyl butyrate
2-tert-butyl cyclohexanone
 butyl hexanoate
isobutyl isovalerate
 butyl valerate
isobutyl-3-(methyl thio) butyrate
 butyrophenone
 cajuput oil vietnam
(+)-camphene
 camphene hydrate
 camphenilone
 campholene acetate
alpha-campholenic alcohol
(±)-camphor
dextro-camphor
 camphor oil
 cardamom seed oil
 carvacrol
 cedarleaf oil terpeneless
 chamomile oil morocco
 cherry propanol
1,4-cineole
1,8-cineole
 conifer acetate
ortho-cresyl isobutyrate
 cubeb oleoresin
beta-homocyclocitral
 cyclohexyl ethyl acetate
beta-damascenone
alpha-damascone
 davana oil
 dihydro-alpha-ionone
isodihydrolavandulal
 dihydrolinalool
 epoxyoxophorone
2,10-epoxypinane
 ethyl 2-hydroxy-3-methyl valerate
 ethyl 2-methyl-2-pentenoate
 ethyl 3-oxohexanoate
2-ethyl butyric acid
 ethyl cinnamate
2-ethyl fenchol
 ethyl levulinate
 ethyl maltol
 ethyl methyl-para-tolyl glycidate
 ethyl ortho-anisate
 ethyl valerate
 eucalyptus oil
 fenchone
dextro-fenchone
laevo-fenchone
 fenchyl alcohol
 fennel seed oil bitter spain
 feverfew leaf oil belgium
 filbert hexenone
 fir balsam absolute
 fruity ketal
 furfuryl isovalerate
(E)-furfurylidene phenyl acetaldehyde
 galangal root oil
 geranic oxide
 geranyl butyrate
 geranyl isovalerate
 heliotropyl acetate
 heliotropyl acetone
 heliotropyl isobutyrate
 herbal dioxane
 herbal ethanone
 herbal undecanol
 herbal undecanone
(Z)-3-hexen-1-yl 2-methyl butyrate
 hexyl isobutyrate
 hexyl isovalerate
 hexyl octanoate
 hinoki leaf oil
 hinoki root oil
 hyacinth ether
6-hydroxydihydrotheaspirane (mixture of isomers)
 hyssop oil
beta-ionone
beta-ionone epoxide
beta-ionyl acetate
 juniper berry oleoresin
 laurel bark oil
 laurel berry absolute
 laurel berry oil
 laurel leaf absolute
 laurel leaf oil
 laurel stem oil
 lavandin oil
 lavender oil spike france
 lavender spike absolute
 leather propionate
 linalool oxide (furanoid)
 maltyl isobutyrate
 maltyl propionate
 mango thiol
 marjoram absolute spain
 marjoram oil
isomenthone
dextro,laevo-menthyl acetate
 methyl (E)-cinnamate
 methyl 2-methyl valerate
 methyl beta-ionol
 methyl cinnamate
 methyl cyclogeranate
3-methyl cyclohexanone
 methyl ethyl ketone
 methyl furfuryl disulfide
 methyl heptanoate
1-methyl naphthalene
 methyl propionate
2-methyl-2-pentenoic acid
2-methyl-3-butanone
2-methyl-3-pentenoic acid
 myrtenal
 myrtle oil
 nerolin fragarol
 neryl isobutyrate
 niaouli oil
3-nonen-2-one
 ocimene quintoxide
(E)-2-octen-1-yl butyrate
3-octen-2-one
(E)-2-octen-4-ol
 octyl propionate
 orris hexanone
 orris root resinoid
 osmanthus absolute
 patchouli ethanol
 patchouli hexanol
 patchouli indene
 peppermint cyclohexanone
 phenethyl butyrate
2-phenethyl isothiocyanate
 phenethyl pivalate
3-phenyl propyl isovalerate
 phenyl propyl valerate
(Z,Z)-photocitral A
 pine hexanol
 pine needle oil dwarf
alpha-pinene
 pinocarveol
 piperitone
isopropenyl acetate
 propyl acetate
 propyl formate
 propyl heptanoate
isopropyl hexanoate
 propyl isobutyrate
 prune glycidate
 pulegone
 raspberry ketone
 raspberry ketone acetate
 raspberry ketone methyl ether
 rose carboxylate
 rosemary absolute
 rosemary oil
 rosemary oil morocco
 sage absolute spain
 sage oil spain
 sandal glycol acetal
 strawberry furanone
 strawberry glycidate 1
 strawberry glycidate 2
 styralyl butyrate
 sugandha kokila berry oil
 tetrahydroionyl acetate
 thiogeraniol
 thyme oil
4-(para-tolyl)-2-butanone
 tropical trithiane
 vanilla carboxylate
 verbenone
laevo-verbenone
 xanthoxylin
 yarrow oil
 zedoary bark oil
 zvoulimba oil

(odor and/or flavor) used in :
 berry
 cassis black currant bud
 fruit
 herbal

natural occurrence in :
juniperus communis



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