Basic information
- CAS
16248-66-1- Standard SMILES
O=S(=O)(Cc1ccccc1)C(c1ccccc1)C(O)(c1ccccc1)c1ccccc1- InChIKey
LVNDFAKBQMCCEG-UHFFFAOYSA-N- Molecular formula
- C27H24O3S
- Average molar mass
- 428.5 g/mol
- Monoisotopic mass
- 428.1446158
Names & identifiers
- Preferred name
- 2-Benzylsulfonyl-1,1,2-triphenylethanol
- IUPAC
- 2-benzylsulfonyl-1,1,2-triphenylethanol
Names & synonyms
16248-66-12-benzylsulfonyl-1,1,2-triphenylethanolNSC137591DTXSID40329601NSC-137591DS-0101401,1,2-Triphenyl-2-(phenylmethanesulfonyl)ethan-1-olBENZENEETHANOL, A,A-DIPHENYL-B-[(PHENYLMETHYL)SULFONYL]-
Database identifiers
- CAS
16248-66-1- PubChem CID
- 421663
- DTXSID
DTXSID40329601
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 610
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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