Basic information
- CAS
88047-90-9- Standard SMILES
CC1(C)C(=S)N(c2ccccc2)C1c1ccccc1- InChIKey
HLZMLYUMSSGGME-UHFFFAOYSA-N- Molecular formula
- C17H17NS
- Average molar mass
- 267.4 g/mol
- Monoisotopic mass
- 267.10817072
Names & identifiers
- Preferred name
- 2-Azetidinethione, 3,3-dimethyl-1,4-diphenyl-
- IUPAC
- 3,3-dimethyl-1,4-diphenylazetidine-2-thione
Names & synonyms
2-Azetidinethione, 3,3-dimethyl-1,4-diphenyl-88047-90-9DTXSID50342604RefChem:256162DTXCID702936843,3-dimethyl-1,4-diphenylazetidine-2-thioneHLZMLYUMSSGGME-UHFFFAOYSA-N3,3-Dimethyl-1,4-diphenyl-2-azetidinethione #Azetidin32-thione, 3,3-dimethyl-1,4-diphenyl-
Database identifiers
- CAS
88047-90-9- PubChem CID
- 583286
- DTXSID
DTXSID50342604
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 337
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…