Basic information
- CAS
16766-64-6- Standard SMILES
O=S1(=O)CCC(c2ccccc2)C1- InChIKey
LKPQZMTWAPOZMV-UHFFFAOYSA-N- Molecular formula
- C10H12O2S
- Average molar mass
- 196.27 g/mol
- Monoisotopic mass
- 196.05580079
Names & identifiers
- Preferred name
- 3-Phenyltetrahydrothiophene 1,1-dioxide
- IUPAC
- 3-phenylthiolane 1,1-dioxide
- English name
- Thiophene,tetrahydro-3-phenyl-, 1,1-dioxide
- Molecular formula
- C10H12O2S
- Molecular weight
- 196.27
Names & synonyms
3-Phenyltetrahydrothiophene 1,1-dioxide16766-64-63-phenylthiolane 1,1-dioxide3-phenylsulfolaneNSC229613A1DOI3-phenylthiolane-1,1-dione3-Phenylthiolane,S,S-dioxideSCHEMBL960888DTXSID80310659LKPQZMTWAPOZMV-UHFFFAOYSA-NHMS1672I21
Show more names
Thiophene,tetrahydro-3-phenyl-, 1,1-dioxide
SMSSF-0064734STK369219AKOS000523175AKOS016044283NSC-2296133-Phenyl-1lambda~6~-thiolane-1,1-dione3-Phenyltetrahydrothiophene 1,1-dioxide #CS-0359929
Database identifiers
- CAS
16766-64-6- PubChem CID
- 313894
- DTXSID
DTXSID80310659
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 257
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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