Completing data — usually done within a minute
Basic information
- CAS
58019-66-2- Standard SMILES
CCCCCC(C)C(C)c1cc(O)c2c(c1)OC(C)(C)C1=C2C(C)CCC1- InChIKey
XOZQPDXSJUBMOT-UHFFFAOYSA-N- Molecular formula
- C25H38O2
- Average molar mass
- 370.6 g/mol
- Monoisotopic mass
- 370.28718046
Names & identifiers
- Preferred name
- 6H-Dibenzo(b,d)pyran-1-ol, 7,8,9,10-tetrahydro-3-(1,2-dimethylheptyl)-6,6,10-trimethyl-
- IUPAC
- 6,6,10-trimethyl-3-(3-methyloctan-2-yl)-7,8,9,10-tetrahydrobenzo[c]chromen-1-ol
Names & synonyms
BRN 15963977,8,9,10-Tetrahydro-3-(1,2-dimethylheptyl)-6,6,10-trimethyl-6H-dibenzo(b,d)pyran-1-ol58019-66-25-17-04-00438 (Beilstein Handbook Reference)6H-Dibenzo(b,d)pyran-1-ol, 7,8,9,10-tetrahydro-3-(1,2-dimethylheptyl)-6,6,10-trimethyl-RefChem:309605CHEMBL3276139SCHEMBL11740560SCHEMBL31545894DTXSID00973604XOZQPDXSJUBMOT-UHFFFAOYSA-N6,6,10-Trimethyl-3-(3-methyloctan-2-yl)-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-ol
Show more names
1-Hydroxy-3-(3-methyl-2-octyl)-7,8,9,10-tetrahydro-6,6,10-trimethyl-6H-dibenzo[ b,d] pyran1-hydroxy-3-(3-methyl-2-octyl)-7,8,9,10-tetrahydro-6,6,10-trimethyl-6H-dibenzo[b,d]pyran
Database identifiers
- CAS
58019-66-2- PubChem CID
- 3045010
- DTXSID
DTXSID00973604- ChEMBL
CHEMBL3276139
Properties
Computed structural propertiesFilling in
- XLogP
- 7.4
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 534
Related reactions
4 records
Compound notes
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