Benzo(b)thiophene-3-methanol, 2,3-dihydro-2-(2-hydroxyphenyl)-
Basic information
- CAS
79592-73-7- Standard SMILES
OCC1c2ccccc2SC1c1ccccc1O- InChIKey
YNLMGNLRJHQQEF-UHFFFAOYSA-N- Molecular formula
- C15H14O2S
- Average molar mass
- 258.3 g/mol
- Monoisotopic mass
- 258.07145086
Names & identifiers
- Preferred name
- Benzo(b)thiophene-3-methanol, 2,3-dihydro-2-(2-hydroxyphenyl)-
- IUPAC
- 2-[3-(hydroxymethyl)-2,3-dihydro-1-benzothiophen-2-yl]phenol
Names & synonyms
2,3-Dihydro-2-(2-hydroxyphenyl)benzo(b)thiophene-3-methanol79592-73-7Benzo(b)thiophene-3-methanol, 2,3-dihydro-2-(2-hydroxyphenyl)-RefChem:3262542-[3-(hydroxymethyl)-2,3-dihydro-1-benzothiophen-2-yl]phenolDTXSID0010006072-[3-(hydroxymethyl)-2,3-dihydrobenzothiophen-2-yl]phenol2-(2-Hydroxyphenyl)-3-hydroxymethyl-2,3- dihydrobenzo[b]thiophene
Database identifiers
- CAS
79592-73-7- PubChem CID
- 457212
- DTXSID
DTXSID001000607- Nikkaji
- J535.961I
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 65.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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