pinocarvone
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IUPAC name :7,7-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-one
InChI :InChI=1/C10H14O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h7-8H,1,4-5H2,2-3H3
InChIKey :TZDMGBLPGZXHJI-UHFFFAOYAP
SMILES :CC1(C2CC1C(=C)C(=O)C2)C
cas number :30460-92-5
(EINECS) number :250-211-9
molar refractivity :43.87 ± 0.4 cm3
parachor :354.2 ± 6.0 cm3
index of refraction :1.495 ± 0.03
surface tension :30.8 ± 5.0 dyne/cm
density :0.99 ± 0.1 g/cm3
polarizability :17.39 ± 0.5 10-24cm3
XlogP : 2.20
molecular weight : 150.2175600
formula :C10 H14 O
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified
organoleptics :
odor strength :medium
odor description :
at 100.00 %.  		minty
properties :
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.98750 @ 15.00 °C.
refractive index :1.49490 @ 20.00 °C.
boiling point : 217.00 to 218.00 °C. @ 760.00 mm Hg
flash point : 185.00  °F.  TCC  ( 85.00 °C. )
logP (o/w) : 1.88
safety :
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
 
recommendation for pinocarvone usage levels up to :
  2.0000 % in the fragrance concentrate.
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
 
 
 7,7-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-one
(EINECS) number :250-211-9
chemidplus :030460925
EPA Substance Registry Services :30460-92-5
references :
 7,7-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-one
NIST Chemistry WebBook :1365697804
pubchem :698215
other :
VCF-Online: VCF Volatile Compounds in Food
synonyms :
6,6-dimethyl-2-methylene bicyclo(3.1.1)heptan-3-one
7,7-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-one
3-nopinenone
(±)-2(10)-pinen-3-one
2(10)-pinen-3-one
alpha-pinocarvone
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
2-acetoxy-1,8-cineole
 agathosma crenulata oil
 armoise oil
 artemisyl ketone
 basil oleoresin sweet
 benzyl mercaptan
3-benzyl-4-heptanone
isobornyl formate
 buchu leaf oil
 buchu mercaptan
para-tert-butyl cyclohexanone
isobutyraldehyde
 camphene hydrate
dextro-camphor
 camphor oil
laevo-carveol
 carvone
laevo-carvone
(Z)-carvone-5,6-oxide
 carvyl propionate
1,4-cineole
 citronellal diisotridecyl acetal
 cornmint oil
 cornmint oil india
 cornmint oil terpeneless
 costmary oil
beta-cyclocitral
 cyclohexanone
 cyclohexyl ethyl acetate
 cyclohexyl propanol
 cyclopentanone
2-cyclopentyl cyclopentanone
2-decalinol
 dehydroxylinalool oxide
N,N-diethyl octanamide
 dihydrocarveol
 dihydrocarvyl acetate
isodihydrolavandulol
isodihydrolavandulyl acetate
2',4'-dimethyl acetophenone
2-(1,1-dimethyl ethyl)-4-methyl cyclohexanol
(±)-N,N-dimethyl menthyl succinamide
 diosphenol
 earthy indane
 estragole
 ethyl salicylate
 eucarvone
 floral methanol
 foeniculum vulgare piperitum oil
 geranium absolute
 geranium oil china
 grapefruit menthane
isoheptyl acetate
 herbal ethanone
 herbal undecanol
 hyssop oil
 lilac lactone
 limonen-10-yl acetate
(E)-para-mentha-2,8-dien-1-ol
dextro-2,8-para-menthadien-1-ol
(Z+E)-para-1(7)8-menthadien-2-yl acetate
 menthadienyl formate
(E)-para-menthan-2-one
para-menthane-3,8-diol
 menthol
dextro-neomenthol
dextro,laevo-menthol
homomenthol
laevo-menthol
isomenthone
laevo-menthone
 menthone
3-laevo-menthoxy-2-methyl propane-1,2-diol
 menthoxypropane diol
 menthyl acetate
dextro,laevo-menthyl acetate
homomenthyl acetate
laevo-menthyl acetate
laevo-monomenthyl glutarate
laevo-menthyl methyl ether
 menthyl methyl lactate
 menthyl propylene glycol carbonate
2-methyl 3-(methyl thio) furan 10% in triacetin
4-methyl biphenyl
2-methyl cyclohexanone
 methyl salicylate
 muguet butanol
 myrtenol
 nonyl benzoate
 ocimene quintoxide
3-octanol
3-octyl acetate
 patchouli ethanol
 patchouli hexanol
 pennyroyal oil
 pennyroyal oil spain
 pennyroyal oil uruguay
 peppermint cyclohexanone
 peppermint oil
 peppermint oil CO2 extract
 peppermint oil russia
 peppermint oil terpeneless america
 perillaldehyde
laevo-perillaldehyde
beta-phellandrene
(Z,Z)-photocitral A
(Z)-2-pinanol
 pine hexanol
(+)-alpha-pinene
 piperitenone
 piperitenone oxide
 piperitone
dextro-piperitone
laevo-piperitone
isopropyl pyrazine
isopropyl tiglate
isopulegol
 pulegone
isopulegone
isopulegyl acetate
isopulegyl formate
 rosemary absolute
 rosemary oil morocco
 sabinene hydrate
 spearmint absolute
 spearmint oil
 spearmint oil terpeneless
 tansy flower oil canada
 tansy flower oil dutch
 tansy oil
 tetrahydrocarvone
 thiogeraniol
 thujyl alcohol
 trimethyl isopropyl butanamide
 umbellulone
 vanillin menthoxypropane diol acetal
laevo-verbenone
 viridiflorol
 wintergreen oil
 WS-5
 ylang ylang oil
 ylang ylang oil CO2 extract
 ylang ylang oil I
 ylang ylang oil II
 ylang ylang oil III
(odor and/or flavor) used in :
 balsam
 caraway
 herbal
 mint
 spearmint
natural occurrence in :
data pagechamomile oil @ 2.37%
data pagechamomile oil morocco @ 0.50%
data pagecistus oil @ 0.3%
data pagecroton flavens l. (welensali) leaf oil curacao @ 0.10%
data pagecypress cone oil egypt @ 0.3%
eucalyptus globulus
data pageeucalyptus globulus bicostata oil @ 0.92%
data pageeucalyptus globulus bud oil @ 0.10%
data pageeucalyptus globulus maidenii f. muell oil @ 0.82%
data pageeucalyptus globulus oil @ 0.34%
data pageeucalyptus globulus oil rwanda @ 0.04%
data pageeucalyptus globulus oil zambia @ trace%
data pageeucalyptus globulus pseudoglobulus oil @ 2.84%
data pagefeatherfew leaf oil @ 0.14%
data pagefeverfew flower oil @ 0.2%
data pagefeverfew leaf oil belgium @ trace%
data pagehyssop oil CO2 extract @ 20.3%
data pagelabdanum leaf oil @ 0.90%
data pagelabdanum oil @ 1.11%
data pagelaurel leaf oil turkey @ 0.20%
data pagelayana oil kenya @ trace%
data pagemyrtle oil @ 0.09%
data pagenepeta betonicifolia c.a. meyer oil turkey @ 0.10%
data pagenepeta cephalotes boiss. oil iran @ 1.20%
data pagenepeta denudata benth. oil iran @ 1.30%
data pagerosemary oil CO2 extract @ 0.39%
data pagetansy flower oil canada @ 0.83%
data pagetansy oil argentina @ 0.15%
data pagewormwood oil annus france @ 0.24-2.19%
data pagewormwood oil italy @ 0.2%
data pageyarrow leaf oil @ 1.10%
data pageyarrow oil @ 0.40%



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