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delta9-Tetrahydrocannabinol Ethanol
[CAS 1972-08-3]

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Identification
Classification API >> Nervous system medication >> Other nervous system medication
Name delta9-Tetrahydrocannabinol Ethanol
Synonyms (6Ar,10Ar)-3-Amyl-6,6,9-Trimethyl-6A,7,8,10A-Tetrahydrobenzo[C]Chromen-1-Ol; 6,6,9-Trimethyl-3-Pentyl-6A,7,8,10A-Tetrahydro-6H-Benzo[C]Chromen-1-Ol; Compassia
Molecular Structure CAS#: 1972-08-3, delta9-Tetrahydrocannabinol Ethanol
Molecular Formula C21H30O2
Molecular Weight 314.47
CAS Registry Number 1972-08-3
SMILES [C@H]23C1=C(C=C(C=C1OC([C@@H]2CCC(=C3)C)(C)C)CCCCC)O
InChI 1S/C21H30O2/c1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15/h11-13,16-17,22H,5-10H2,1-4H3/t16-,17-/m1/s1
InChIKey CYQFCXCEBYINGO-IAGOWNOFSA-N
Properties
Density 1.0±0.1g/cm3 (Cal.)
Boiling point 390.4±42.0°C at 760 mmHg (Cal.)
Flash point 149.3±22.1°C (Cal.)
solubility Soluble to 50 mM in ethanol
Safety Data
Controlled Substance DEA Drug Code Number: 7369 Details
CSA Schedule: III
Is Narcotics? No
References
(1) Nomura et al.. Activation of the endocannabinoid system by organophosphorus nerve agents, Nature Chemical Biology, 2008
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