CAY10429(Abn-cbd)

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Names

[ CAS No. ]:
22972-55-0

[ Name ]:
CAY10429(Abn-cbd)

[Synonym ]:
ABN-CBD
4-[(1R,6R)-3-Methyl-6-(prop-1-en-2-yl)cyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol
1-Hydroxy-3-n-Pentylcannabidiol
1,3-Benzenediol, 4-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentyl-
4-[(1R,6R)-6-Isopropenyl-3-methyl-2-cyclohexen-1-yl]-5-pentyl-1,3-benzenediol

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
446.4±45.0 °C at 760 mmHg

[ Molecular Formula ]:
C21H30O2

[ Molecular Weight ]:
314.462

[ Flash Point ]:
196.7±23.3 °C

[ Exact Mass ]:
314.224579

[ PSA ]:
40.46000

[ LogP ]:
7.03

[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C

[ Index of Refraction ]:
1.545

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VH1620000
CHEMICAL NAME :
Resorcinol, 4-p-mentha-1,8-dien-3-yl-5-pentyl-, (-)-(E)-
CAS REGISTRY NUMBER :
22972-55-0
LAST UPDATED :
199603
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H28-O2
MOLECULAR WEIGHT :
300.48
WISWESSER LINE NOTATION :
L6UTJ A1 CR BQ DQ F5& DY1&U1 --,E

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
30 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 18,213,1975

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • cis-Isolimonenol
  • Olivetol
  • 3,5-DIMETHOXYBENZYL BROMIDE
  • 4-(3,5-dihydroxyphenyl)-1-bromobutane
  • 5-(4-bromobutyl)-4-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-1,3-benzenediol
  • 5-(4-bromobutyl)-3,5-bis(tert-butyldimethylsilyloxy)-2-(6-isopropenyl-3-methyl-2-cyclohexenyl)benzene
  • 4-(3,5-DIMETHOXYPHENYL)-1-BUTENE
  • 4-(3,5-dimethoxyphenyl)-1-bromobutane
  • 3,5-Dimethoxybenzylalcohol

DownStream

Related Compounds

  • 4-[(1S,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylbenzene-1,3-diol
  • diacetylcannabidiol
  • ACT 335827
  • Cannabidiol monomethyl ether
  • Di(adamantan-1-yl)(benzyl)phosphine
  • 2,1,3-Benzoxadiazole-4-sulfonylchloride,7-fluoro-(9CI)