carvyl acetate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :(2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl) acetate
InChI :InChI=1/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3
InChIKey :YTHRBOFHFYZBRJ-UHFFFAOYAE
SMILES :CC1=CCC(CC1OC(=O)C)C(=C)C
(EINECS) number :202-580-2
cas number :97-42-7
beilstein number :2330666
fema number :2250
coe number :2063
jecfa number :382
fl. number :09.215
molar refractivity :56.59 ± 0.4 cm3
parachor :471.8 ± 6.0 cm3
index of refraction :1.474 ± 0.03
surface tension :30.3 ± 5.0 dyne/cm
density :0.96 ± 0.1 g/cm3
polarizability :22.43 ± 0.5 10-24cm3
xlogp : 2.40
molecular weight : 194.2701200
formula :C12 H18 O2
BioActivity Analysis :17389118
 
 
IUPAC name :[(1R,5R)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] acetate
InChI :InChI=1/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3/t11-,12-/m1/s1
InChIKey :YTHRBOFHFYZBRJ-VXGBXAGGBF
SMILES :CC1=CC[C@H](C[C@H]1OC(=O)C)C(=C)C
cas number :1205-42-1
molar refractivity :56.59 ± 0.4 cm3
parachor :471.8 ± 6.0 cm3
index of refraction :1.474 ± 0.03
surface tension :30.3 ± 5.0 dyne/cm
density :0.96 ± 0.1 g/cm3
polarizability :22.43 ± 0.5 10-24cm3
xlogp : 2.40
molecular weight : 194.2701200
formula :C12 H18 O2
 
 
IUPAC name :[(1R,5S)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] acetate
InChI :InChI=1/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3/t11-,12+/m0/s1
InChIKey :YTHRBOFHFYZBRJ-NWDGAFQWBS
SMILES :CC1=CC[C@@H](C[C@H]1OC(=O)C)C(=C)C
cas number :1134-95-8
molar refractivity :56.59 ± 0.4 cm3
parachor :471.8 ± 6.0 cm3
index of refraction :1.474 ± 0.03
surface tension :30.3 ± 5.0 dyne/cm
density :0.96 ± 0.1 g/cm3
polarizability :22.43 ± 0.5 10-24cm3
xlogp : 2.40
molecular weight : 194.2701200
formula :C12 H18 O2
 
 
IUPAC name :[(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] acetate
InChI :InChI=1/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3/t11-,12+/m1/s1
InChIKey :YTHRBOFHFYZBRJ-NEPJUHHUBY
SMILES :CC1=CC[C@H](C[C@@H]1OC(=O)C)C(=C)C
(EINECS) number :230-332-3
cas number :7053-79-4
molar refractivity :56.59 ± 0.4 cm3
parachor :471.8 ± 6.0 cm3
index of refraction :1.474 ± 0.03
surface tension :30.3 ± 5.0 dyne/cm
density :0.96 ± 0.1 g/cm3
polarizability :22.43 ± 0.5 10-24cm3
xlogp : 2.40
molecular weight : 194.2701200
formula :C12 H18 O2
 
 
IUPAC name :[(1S,5S)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] acetate
InChI :InChI=1/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3/t11-,12-/m0/s1
InChIKey :YTHRBOFHFYZBRJ-RYUDHWBXBQ
SMILES :CC1=CC[C@@H](C[C@@H]1OC(=O)C)C(=C)C
(EINECS) number :230-414-9
cas number :7111-29-7
molar refractivity :56.59 ± 0.4 cm3
parachor :471.8 ± 6.0 cm3
index of refraction :1.474 ± 0.03
surface tension :30.3 ± 5.0 dyne/cm
density :0.96 ± 0.1 g/cm3
polarizability :22.43 ± 0.5 10-24cm3
xlogp : 2.40
molecular weight : 194.2701200
formula :C12 H18 O2
 
 
export tariff code :2915.39.9050
fda reg :unspecified
 
Suppliers :
Sigma-Aldrich-SAFC :(-)Carvyl acetate
≥98%, Mixture of cis and trans isomers, FCC, Kosher, FG
Symrise :Carvyl acetate cis l
organoleptics :
odor type :minty
odor strength :medium
odor description :
at 100.00 %.  		sweet green spearmint fruity
properties :
appearence :colorless to pale yellow clear liquid
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :Yes
specific gravity :0.96110 to 0.97110 @ 25.00 °C.
pounds per gallon - calc. : 7.997 to 8.081
refractive index :1.46910 to 1.47440 @ 20.00 °C.
boiling point : 115.00 to 116.00 °C. @ 10.00 mm Hg
boiling point : 77.00 to 79.00 °C. @ 0.10 mm Hg
acid value : 1.00  max.  KOH/g
logp : 3.52
safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) : 208.00  °F.  TCC  ( 97.78 °C. )
recommendation for carvyl acetate usage levels up to :
  4.0000 % in the fragrance concentrate.
recommendation for carvyl acetate usage levels up to :
  40.0000 ppm in the flavor.
safety links :
 
 
(EINECS) number :202-580-2
RTECS :OS8500000 for 97-42-7
chemidplus :000097427
EPA Substance Registry Services :97-42-7
NLM Chemical Carcinogenesis Research Information System :97-42-7
NLM Developmental and Reproductive Toxicity :97-42-7
NLM Env. Mutagen Info. Center :97-42-7
NLM GENetic TOXicology :97-42-7
 
 
chemidplus :001205421
EPA Substance Registry Services :1205-42-1
NLM Chemical Carcinogenesis Research Information System :1205-42-1
NLM Developmental and Reproductive Toxicity :1205-42-1
NLM Env. Mutagen Info. Center :1205-42-1
NLM GENetic TOXicology :1205-42-1
 
 
chemidplus :5324262
EPA Substance Registry Services :1134-95-8
NLM Chemical Carcinogenesis Research Information System :1134-95-8
NLM Developmental and Reproductive Toxicity :1134-95-8
NLM Env. Mutagen Info. Center :1134-95-8
NLM GENetic TOXicology :1134-95-8
 
 
(EINECS) number :230-332-3
chemidplus :007053794
EPA Substance Registry Services :7053-79-4
NLM Chemical Carcinogenesis Research Information System :7053-79-4
NLM Developmental and Reproductive Toxicity :7053-79-4
NLM Env. Mutagen Info. Center :7053-79-4
NLM GENetic TOXicology :7053-79-4
 
 
(EINECS) number :230-414-9
chemidplus :007111297
EPA Substance Registry Services :7111-29-7
NLM Chemical Carcinogenesis Research Information System :7111-29-7
NLM Developmental and Reproductive Toxicity :7111-29-7
NLM Env. Mutagen Info. Center :7111-29-7
NLM GENetic TOXicology :7111-29-7
EPI System :view
other :
references :
jecfa number :382
fl. number :09.215
pubchem :150394
NIST Chemistry WebBook :3717671675
pubchem :679463
NIST Chemistry WebBook :3245376224
pubchem :43559303
pubchem :658443
pubchem :658481
synonyms :
 carvyl acetate
(-)-carvyl acetate
para-mentha-1(6),8-dien-2-yl acetate
para-mentha-6,8-dien-2-ol acetate
para-mentha-6,8-dien-2-yl acetate
1-para-mentha-6(8,9)-dien-2-yl acetate
2-methyl-5-(1-methyl ethenyl)-2-cyclohexen-1-ol acetate
2-methyl-5-(1-methyl ethenyl)-2-cyclohexen-1-yl acetate
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
 acetaldehyde benzyl 2-methoxyethyl acetal
 acetaldehyde dihexyl acetal
 acetaldehyde methyl hexyl acetal
 allyl amyl glycolate
 allyl butyrate
 allyl tiglate
isoamyl benzoate
isoamyl butyrate
alpha-amyl cinnamaldehyde
alpha-amyl cinnamaldehyde diethyl acetal
isoamyl formate
 amyl furoate
isoamyl heptanoate
 amyl hexanoate
isoamyl isovalerate
isoamyl octanoate
 berry pentadienoate
 buchu mercaptan
 butyl 2-methyl butyrate
 butyl isobutyrate
 butyl levulinate
isobutyl propionate
(E)-carveol
laevo-carveol
laevo-carvone
(Z)-carvone-5,6-oxide
 chamomile valerate
 cherry pentenoate
 citronellyl propionate
 cognac heptanone
para-cresyl isobutyrate
 cuminyl acetate
beta-cyclocitral
 cyclohexyl propanol
2-cyclopentyl cyclopentanone
gamma-damascone
alpha-decalactone
3-decen-2-one
9-decenoic acid
 diethyl malate
 diethyl malonate
 dihydrocarveol
dextro-dihydrocarvone
 dimethyl succinate
6,8-dimethyl-2-nonanol
(E,E)-2,4-dodecadien-1-ol
 ethyl (E)-2-hexenoate
 ethyl (E)-2-octenoate
 ethyl (E)-4-decenoate
 ethyl 2-cyclohexyl propionate
 ethyl 2-octenoate
 ethyl 3-acetoxyhexanoate
 ethyl 3,5,5-trimethyl hexanoate
 ethyl acetoacetate
 ethyl methyl-para-tolyl glycidate
 ethyl salicylate
2-ethyl-4-butanol
 furfuryl propionate
(E)-geranyl acetone
 geranyl isovalerate
 geranyl tiglate
 green dioxolane
(E,E)-2,4-heptadien-1-ol
 heptanal cyclic ethylene acetal
2-heptanol
 heptyl isobutyrate
 hexanal propylene glycol acetal
2-hexen-1-al
(E)-2-hexen-1-al diethyl acetal
2-hexen-1-al diethyl acetal
2-hexen-1-ol
(Z)-3-hexen-1-yl (E)-2-hexenoate
(Z)-3-hexen-1-yl 2-methyl-2-pentenoate
(E)-2-hexen-1-yl acetate
(E)-3-hexen-1-yl acetate
(Z)-3-hexen-1-yl acetate
2-hexen-1-yl acetate
(E)-2-hexen-1-yl formate
(E)-2-hexen-1-yl hexanoate
(Z)-3-hexen-1-yl hexanoate
(Z)-3-hexen-1-yl isobutyrate
(Z)-3-hexen-1-yl isovalerate
(E)-2-hexen-1-yl propionate
(E)-2-hexen-1-yl valerate
(Z)-3-hexen-1-yl valerate
1-hexen-3-yl acetate
(E)-2-hexenoic acid
 hexyl (E)-2-hexenoate
 hexyl 2-butenoate
 hexyl acetate
 hexyl butyrate
 hexyl isobutyrate
 hexyl isovalerate
 hexyl octanoate
 hexyl pivalate
 hexyl propionate
 lily propanol
 linalyl hexanoate
 linalyl octanoate
 melon valerate
para-menth-1-ene-9-ol
(Z+E)-para-1(7)8-menthadien-2-yl acetate
 menthadienyl formate
1-para-menthen-9-yl acetate
 menthone-8-thioacetate
 methyl (E)-2-hexenoate
 methyl (E)-3-nonenoate
 methyl (E)-3-nonenoate
 methyl 2-hexenoate
 methyl 2-undecynoate
 methyl 4-pentenoate
 methyl benzyl acetate (mixed ortho-,meta-,para-)
2-methyl butyl 2-methyl butyrate
(E)-methyl geranate
 methyl heptanoate
 methyl R-3-acetoxyhexanoate
 methyl salicylate
2-methyl valeraldehyde
 methyl valerate
3-methyl valeric acid
(E)-2-methyl-2-octen-1-al
2-methyl-2-octen-1-al
3-methyl-3-pentanol
 mint lactone
 nerolidyl isobutyrate
 nonyl benzoate
 ocimene quintoxide
(E,E)-3,5-octadien-2-one
3-octanon-1-ol
 octen-1-yl cyclopentanone
 octyl 2-methyl butyrate
 octyl butyrate
 orris capronate
 papaya isobutyrate
(E)-2-penten-1-al
2-pentyl furan
 phenoxyethyl isobutyrate
4-phenyl-2-butyl acetate
 pineapple pentenoate
 prenol
 prenyl ethyl ether
 prenyl hexanoate
isopropyl 2-methyl butyrate
alpha-isopropyl phenyl acetaldehyde
isopropyl pyrazine
isopropyl tiglate
isopulegyl formate
 rhubarb undecane
 sorbyl isobutyrate
 spearmint absolute
 spearmint oil
 spearmint oil terpeneless
 tetrahydrocarvone
 tetrahydrofurfuryl butyrate
 thiogeraniol
 tiglaldehyde
 timber dioxolane
 tropical indene
 tropical thiazole
 violet dienyne
 woody acetate
(odor and/or flavor) used in :
 apple
 caraway
 citrus
 guava
 herbal
 mint
 pear
 spearmint
natural occurrence in :
data pageangelica root oil @ 0.21%
mentha aquatica
mentha crispa
data pagevalerian root oil china @ 1.64%



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