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Substance Name: d-Carvone
RN: 2244-16-8
UNII: 4RWC1CMS3X
InChIKey: ULDHMXUKGWMISQ-VIFPVBQESA-N

Classification Codes

  • Mutation Data
  • Skin / Eye Irritant
  • Tumor Data

Molecular Formula

  • C10-H14-O

Molecular Weight

  • 150.22
 
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Names and Synonyms

Results Name

  • D-Carvone

Name of Substance

  • 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (S)-
  • 2-Methyl-5-(1-methylethenyl)-2-cyclohexen-1-one
  • Carvol
  • Carvone

Synonyms

  • (S)-(+)-p-Mentha-6,8-dien-2-one
  • (S)-Carvone
  • (S)-d-p-Mentha-6,8,(9)-dien-2-one
  • 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (S)-
  • AI3-39004
  • Carvone, (+)-
  • CCRIS 2385
  • D(+)-Carvone
  • d-1-Methyl-4-isopropenyl-6-cyclohexen-2-one
  • D-Carvone
  • d-Carvone (natural)
  • d-p-Mentha-6,8,(9)-dien-2-one
  • EINECS 218-827-2
  • UNII-4RWC1CMS3X

Systematic Names

  • (S)-2-Methyl-5-(1-methylvinyl)cyclohex-2-en-1-one
  • 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (5S)-
  • 2-Cyclohexen-1-one, 2-methyl-5-(1-methylethenyl)-, (S)-
  • D-Carvone
  • p-Mentha-6,8-dien-2-one, (S)-(+)-

Superlist Name

  • D-Carvone

Registry Numbers

CAS Registry Number

  • 2244-16-8

FDA UNII

  • 4RWC1CMS3X

Other Registry Number

  • 53763-73-8

System Generated Number

  • 0002244168

Structure Descriptors

InChI

1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3/t9-/m0/s1

InChIKey

ULDHMXUKGWMISQ-VIFPVBQESA-N

Smiles

C1[C@H](CC=C(C1=O)C)C(C)=C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 4mL/kg (4mL/kg) SKIN AND APPENDAGES (SKIN): "DERMATITIS, OTHER: AFTER SYSTEMIC EXPOSURE" Food and Cosmetics Toxicology. Vol. 16, Pg. 673, 1978.
rat LD50 oral 3710uL/kg (3.71mL/kg)   Food and Cosmetics Toxicology. Vol. 16, Pg. 673, 1978.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point <15 deg C   EXP
Boiling Point 231 deg C   EXP
log P (octanol-water) 3.070 (none)   EST
Water Solubility 1300 mg/L 18 EXP
Atmospheric OH Rate Constant 1.41E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.