UCSF

ZINC00967816

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2004 11 Yes

Popular Name: Dihydrocarvone Dihydrocarvone

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CAS Numbers: 1862-41-5; 5524-05-0 , 5524-05-0 , 7764-50-3 , [7764-50-3]

Other Names:

(+)-DIHYDROCARVONE

(+)-Dihydrocarvone [5524-05-0]

(+)-Dihydrocarvone, 98%, mixture of isomers

(+)-DIHYDROCARVONE; [5524-05-0]

(1R,4R)-Dihydrocarvone

(1R,4R)-Dihydrocarvone; (1R,4R)-dihydrocarvone; (2R,5R)-2-methyl-5-isopropenylcyclohexanone; (2R,5R)-5-isopropenyl-2-methylcyclohexanone; (2R-trans)-2-Methyl-5-(1-methylvinyl)cyclohexan-1-one; d-Dihydrocarvone

(1R,4R)-dihydrocarvone; (E)-dihydrocarvone; CPD-10039; d-dihydrocarvone

(1R,4R)-Dihydrocarvone; C11398

(2R,5R)-2-Methyl-5-(prop-1-en-2-yl)cyclohexanone

1,6-Dihydrocarvone;2-Methyl-5-(1-methylethenyl)-Cyclohexanone;2-Methyl-5-(1-methylethenyl)cyclohexanone;2-Methyl-5-(1-methylethenyl)cyclohexanone, 9CI;2-Methyl-5-(1-methylvinyl)cyclohexan-1-one;2-Methyl-5-(prop-1-en-2-yl)cyclohexanone;2-Methyl-5-isopropen

2-Methyl-5-(1-methylethenyl)cyclohexanone, cis-; 3-Isopropenyl-6-methylcyclohexanone, cis-; Cyclohexanone, 2-methyl-5-(1-methylethenyl)-, cis-; Dihydrocarvone, cis-; LS-2666; Menth-8-en-2-one, cis-p-; cis-dihydrocarvone; p-Menth-8-en-2-one, cis-

2-Methyl-5-(1-methylethenyl)cyclohexanone; 2-Methyl-5-(1-methylvinyl)cyclohexan-1-one; Cyclohexanone, 2-methyl-5-(1-methylethenyl)-; Dihydrocarvone; EINECS 231-857-0; FEMA No. 3565; LS-89528; p-Menth-8-en-2-one

2-Methyl-5-(1-methylethenyl)cyclohexanone; 2-methyl-5-isopropenylcyclohexanone; 5-isopropenyl-2-methylcyclohexanone; 8-p-Menthen-2-one; a dihydrocarvone; dihydrocarvone; p-Menth-8(9)-en-2-one

2-Methyl-5-(1-methylethenyl)cyclohexanone; 7764-50-3; C18018; Menth-8-en-2-one; p-Menth-8-en-2-one

2044615

C11398

D-Dihydrocarvone

MFCD00001636

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.46 2.36 -4.53 0 1 0 17 152.237 1 ↓

Vendor Notes

Note Type Comments Provided By
BP [°C] 87 - 88 (p=6 torr) Acros Organics
UniProt Database Links MLHB_RHOER ChEBI
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics
Patent Database Links WO2005014569 ChEBI

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Analogs ( Draw Identity 99% 90% 80% 70% )