2-[(Phenylsulfinyl)methyl]oxirane
Basic information
- CAS
66464-42-4- Standard SMILES
O=S(CC1CO1)c1ccccc1- InChIKey
XJGHUDJAFXYWAS-UHFFFAOYSA-N- Molecular formula
- C9H10O2S
- Average molar mass
- 182.24 g/mol
- Monoisotopic mass
- 182.04015073
Names & identifiers
- Preferred name
- 2-[(Phenylsulfinyl)methyl]oxirane
- IUPAC
- 2-(benzenesulfinylmethyl)oxirane
Names & synonyms
2-[(Phenylsulfinyl)methyl]oxirane66464-42-42,3-epoxypropyl phenyl sulfoxideDTXSID50337858XJGHUDJAFXYWAS-UHFFFAOYSA-N1-[(Phenylsulfinyl)methyl]oxirane2-(benzenesulfinyl-methyl)-oxirane2-[(benzenesulfinyl)methyl]oxirane2-[(Phenylsulfinyl)methyl]oxirane #AKOS015905589
Database identifiers
- CAS
66464-42-4- PubChem CID
- 545144
- DTXSID
DTXSID50337858
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 48.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 175
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…