carvyl propionate
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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) propanoate
InChI :InChI=1/C13H20O2/c1-5-13(14)15-12-8-11(9(2)3)7-6-10(12)4/h6,11-12H,2,5,7-8H2,1,3-4H3
InChIKey :DFVXNZOMAOGTBL-UHFFFAOYAS
SMILES :CCC(=O)OC1CC(CC=C1C)C(=C)C
cas number :97-45-0
(EINECS) number :202-583-9
beilstein number :2526499
fema number :2251
coe number :424
jecfa number :383
fl. number :09.143
molar refractivity :61.22 ± 0.4 cm3
parachor :511.9 ± 6.0 cm3
index of refraction :1.475 ± 0.03
surface tension :30.7 ± 5.0 dyne/cm
density :0.95 ± 0.1 g/cm3
polarizability :24.27 ± 0.5 10-24cm3
XlogP : 2.70
molecular weight : 208.2967000 (IUPAC)
formula :C13 H20 O2
NMR Predictor :Predict
 
 
IUPAC name :[(1R,5R)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
InChI :InChI=1/C13H20O2/c1-5-13(14)15-12-8-11(9(2)3)7-6-10(12)4/h6,11-12H,2,5,7-8H2,1,3-4H3/t11-,12-/m1/s1
InChIKey :DFVXNZOMAOGTBL-VXGBXAGGBT
SMILES :CCC(=O)O[C@@H]1C[C@@H](CC=C1C)C(=C)C
cas number :97-45-0  (RR)
molar refractivity :61.22 ± 0.4 cm3
parachor :511.9 ± 6.0 cm3
index of refraction :1.475 ± 0.03
surface tension :30.7 ± 5.0 dyne/cm
density :0.95 ± 0.1 g/cm3
polarizability :24.27 ± 0.5 10-24cm3
XlogP : 2.70
molecular weight : 208.2967000 (IUPAC)
formula :C13 H20 O2
NMR Predictor :Predict
 
 
IUPAC name :[(1R,5S)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
InChI :InChI=1/C13H20O2/c1-5-13(14)15-12-8-11(9(2)3)7-6-10(12)4/h6,11-12H,2,5,7-8H2,1,3-4H3/t11-,12+/m0/s1
InChIKey :DFVXNZOMAOGTBL-NWDGAFQWBG
SMILES :CCC(=O)O[C@@H]1C[C@H](CC=C1C)C(=C)C
cas number :74431-24-6
molar refractivity :61.22 ± 0.4 cm3
parachor :511.9 ± 6.0 cm3
index of refraction :1.475 ± 0.03
surface tension :30.7 ± 5.0 dyne/cm
density :0.95 ± 0.1 g/cm3
polarizability :24.27 ± 0.5 10-24cm3
XlogP : 2.70
molecular weight : 208.2967000 (IUPAC)
formula :C13 H20 O2
NMR Predictor :Predict
 
 
IUPAC name :[(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
InChI :InChI=1/C13H20O2/c1-5-13(14)15-12-8-11(9(2)3)7-6-10(12)4/h6,11-12H,2,5,7-8H2,1,3-4H3/t11-,12+/m1/s1
InChIKey :DFVXNZOMAOGTBL-NEPJUHHUBM
SMILES :CCC(=O)O[C@H]1C[C@@H](CC=C1C)C(=C)C
cas number :97-45-0  (SR)
molar refractivity :61.22 ± 0.4 cm3
parachor :511.9 ± 6.0 cm3
index of refraction :1.475 ± 0.03
surface tension :30.7 ± 5.0 dyne/cm
density :0.95 ± 0.1 g/cm3
polarizability :24.27 ± 0.5 10-24cm3
XlogP : 2.70
molecular weight : 208.2967000 (IUPAC)
formula :C13 H20 O2
NMR Predictor :Predict
 
 
IUPAC name :[(1S,5S)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
InChI :InChI=1/C13H20O2/c1-5-13(14)15-12-8-11(9(2)3)7-6-10(12)4/h6,11-12H,2,5,7-8H2,1,3-4H3/t11-,12-/m0/s1
InChIKey :DFVXNZOMAOGTBL-RYUDHWBXBE
SMILES :CCC(=O)O[C@H]1C[C@H](CC=C1C)C(=C)C
cas number :97-45-0  (SS)
molar refractivity :61.22 ± 0.4 cm3
parachor :511.9 ± 6.0 cm3
index of refraction :1.475 ± 0.03
surface tension :30.7 ± 5.0 dyne/cm
density :0.95 ± 0.1 g/cm3
polarizability :24.27 ± 0.5 10-24cm3
XlogP : 2.70
molecular weight : 208.2967000 (IUPAC)
formula :C13 H20 O2
NMR Predictor :Predict
 
 
export tariff code :2915.50.3000
fda reg :172.515
Suppliers :
Inoue :CARVYL PROPIONATE
Penta :carveol propionate
Sigma-Aldrich-SAFC :(-)Carvyl propionate
≥97%, Kosher
Vigon :Carvyl Propionate Laevo
Odor:  SWEET, WARM, MINTY AND FRUITY
organoleptics :
odor type :minty
odor strength :medium
odor description :
at 100.00 %.  		sweet warm minty fruity
properties :
appearence :colorless clear liquid
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.94000 to 0.96200 @ 25.00 °C.
pounds per gallon - calc. : 7.822 to 8.005
refractive index :1.46900 to 1.47900 @ 20.00 °C.
boiling point : 78.00 to 80.00 °C. @ 0.20 mm Hg
boiling point : 239.00 °C. @ 760.00 mm Hg
flash point : 226.00  °F.  TCC  ( 107.78 °C. )
logP (o/w) : 4.05
safety :
Human experience : 4 % solution: no irritation or sensitization.
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
Maximised Survey-derived Daily Intakes (MSDI-EU) :ND (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :0.04 (μg/capita/day)
Structure Class :I
 
recommendation for carvyl propionate usage levels up to :
  4.0000 % in the fragrance concentrate.
recommendation for carvyl propionate usage levels up to :
  25.0000 ppm in the flavor.
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
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :3
 
 
 
 (2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl) propanoate
(EINECS) number :202-583-9
RTECS :OS8525000 for 97-45-0
chemidplus :000097450
EPA Substance Registry Services :97-45-0
 [(1R,5R)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
 
 
 [(1R,5S)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
chemidplus :74431-24-6
EPA Substance Registry Services :74431-24-6
 [(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
 [(1S,5S)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
references :
 (2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl) propanoate
fl. number :09.143
jecfa number :383
NIST Chemistry WebBook :1295368390
pubchem :150396
 [(1R,5R)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
pubchem :44871948
 [(1R,5S)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
pubchem :44871946
 [(1S,5R)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
 [(1S,5S)-2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl] propanoate
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
synonyms :
laevo-carvyl propionate
(-)-carvyl propionate
para-mentha-1(6),8-dien-2-yl propionate
para-mentha-6,8-dien-2-ol propionate
para-mentha-6,8-dien-2-yl propionate
laevo-para-mentha-6,8(9)-dien-2-yl propionate
2-methyl-5-(1-methyl ethenyl)-2-cyclohexenyl propanoate
(2-methyl-5-prop-1-en-2-yl-1-cyclohex-2-enyl) propanoate
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
 citronellal diisotridecyl acetal
beta-cyclocitral
 lilac lactone
 limonen-10-yl acetate
 menthyl acetate
dextro,laevo-menthyl acetate
(odor and/or flavor) used in :
 herbal
 mint
 peppermint
natural occurrence in :
not found in nature



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