6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo(c)chromen-1-ol

HCID 2978

Basic information

CAS
16849-50-6
Standard SMILES
CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
InChIKey
CYQFCXCEBYINGO-UHFFFAOYSA-N
Molecular formula
C21H30O2
Average molar mass
314.5 g/mol
Monoisotopic mass
314.2245802

Overview

6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-ol is a 1-benzopyran.

Names & identifiers

Preferred name
6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo(c)chromen-1-ol
IUPAC
6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-ol
English name
6a,7,8,10a-Tetrahydro-6,6,9-trimethyl-3-pentyl-6H-dibenzo[b,d]pyran-1-ol
Molecular formula
C21H30O2
Molecular weight
314.46

Names & synonyms

DTXSID208596936,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo(c)chromen-1-olRefChem:1073561DTXCID102091086,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-ol16849-50-66a,7,8,10a-Tetrahydro-6,6,9-trimethyl-3-pentyl-6H-dibenzo[b,d]pyran-1-olDelta 9-THCTHC, delta 9.DELTA.1-Tetrahydrocannabinol(-)-.DELTA.9-THC
Show more names
(L)-.delta.1-TetrahydrocannabinolCannabinol, .DELTA.1-tetrahydro-(-)-.DELTA.1-Tetrahydrocannabinol(-)-.DELTA.9-Tetrahydrocannabinol.DELTA.9-trans-TetrahydrocannabinolL-.delta.1-trans-TetrahydrocannabinolL-trans-.delta.9-Tetrahydrocannabinol(+)-?9-THC

Database identifiers

CAS
16849-50-6
PubChem CID
2978
DTXSID
DTXSID20859693
ChEBI
CHEBI:143723
Nikkaji
J280.524C

Properties

Computed structural properties

XLogP
7
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
23

Chemistry & industry

Additional notes

DefinitionChEBI: 6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-ol is a 1-benzopyran.

Related reactions

6 records

Compound notes

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