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Substance Name: Methyl-delta8-tetrahydrocannabinol
RN: 1451-20-3
InChIKey: GRLARWXSTOXAGR-QZTJIDSGSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H32-O2

Molecular Weight

  • 328.4928
 
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Names and Synonyms

Name of Substance

  • Methyl-delta8-tetrahydrocannabinol

Synonyms

  • 1-Methyl-delta(sup 8)-thc
  • 1-methyl-delta8-THC

Systematic Name

  • 6H-Dibenzo(b,d)pyran, 6a,7,10,10a-tetrahydro-1-methoxy-6,6,9-trimethyl-3-pentyl-, (6aR-trans)-

Registry Numbers

CAS Registry Number

  • 1451-20-3

Other Registry Number

  • 101565-06-4

System Generated Number

  • 0001451203

Structure Descriptors

InChI

1S/C22H32O2/c1-6-7-8-9-16-13-19(23-5)21-17-12-15(2)10-11-18(17)22(3,4)24-20(21)14-16/h10,13-14,17-18H,6-9,11-12H2,1-5H3/t17-,18-/m1/s1

InChIKey

GRLARWXSTOXAGR-QZTJIDSGSA-N

Smiles

CCCCCc1cc(OC)c2[C@@H]3CC(=CC[C@H]3C(C)(C)Oc2c1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 350mg/kg (350mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 207, Pg. 165, 1978.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 8.06 (none)   EXP
Water Solubility 1.09E-03 mg/L 25 EST
Vapor Pressure 5.84E-07 mm Hg 25 EST
Henry's Law Constant 1.39E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.10E-10 cm3/molecule-sec 25 EST

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