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Substance Name: d-Verbenone
RN: 18309-32-5
UNII: 99S17893UW
InChIKey: DCSCXTJOXBUFGB-SFYZADRCSA-N

Note

  • Platelet aggregation inhibitor.

Molecular Formula

  • C10-H14-O

Molecular Weight

  • 150.2196
 
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Names and Synonyms

Name of Substance

  • d-Verbenone

Synonyms

  • (1R-cis)-4,6,6-Trimethylbicyclo(3.1.1)hept-3-en-2-one
  • (1R-cis)-4,6,6-Trimethylbicyclo(3.1.1)hept-3-ene-2-one
  • (R)-(+)-Verbenone
  • 4,6,6-Trimethyl-(1R)-bicyclohept-3-en-2-one
  • 4-07-00-00327 (Beilstein Handbook Reference)
  • AI3-23082
  • Bicyclo(3.1.1)hept-3-en-2-one, 4,6,6-trimethyl-, (1R-cis)-
  • BRN 2042766
  • d-Verbenone
  • EINECS 242-195-7
  • NSC 36846
  • UNII-99S17893UW
  • Verbenone
  • Verbenone (VAN)
  • Verbinone

Systematic Names

  • (1R)-4,6,6-Trimethylbicyclo(3.1.1)hept-3-en-2-one
  • 2-Pinen-4-one, (1R,5R)-(+)-
  • Bicyclo(3.1.1)hept-3-en-2-one, 4,6,6-trimethyl-, (1R,5R)-

Registry Numbers

CAS Registry Number

  • 18309-32-5

FDA UNII

  • 99S17893UW

System Generated Number

  • 0018309325

Structure Descriptors

InChI

1S/C10H14O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-8H,5H2,1-3H3/t7-,8+/m1/s1

InChIKey

DCSCXTJOXBUFGB-SFYZADRCSA-N

Smiles

C1([C@H]2C(=CC(=O)[C@@H]1C2)C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 250mg/kg (250mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 7, Pg. 794, 1955.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 9.8 deg C   EXP
Boiling Point 227.5 deg C   EXP
log P (octanol-water) 3.210 (none)   EST
Atmospheric OH Rate Constant 8.14E-11 cm3/molecule-sec 25 EST

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