Basic information
- CAS
7215-15-8- Standard SMILES
CC(C)CN1CC(c2ccccc2)C1- InChIKey
XACYTWVGVOHHMB-UHFFFAOYSA-N- Molecular formula
- C13H19N
- Average molar mass
- 189.3 g/mol
- Monoisotopic mass
- 189.15174961
Names & identifiers
- Preferred name
- Azetidine, 1-isobutyl-3-phenyl-
- IUPAC
- 1-(2-methylpropyl)-3-phenylazetidine
Names & synonyms
AZETIDINE, 1-ISOBUTYL-3-PHENYL-7215-15-81-Isobutyl-3-phenylazetidineL 23591-(2-methylpropyl)-3-phenylazetidine1-Isobutil-3-fenilazetidina [Italian]BRN 13693521-Isobutil-3-fenilazetidinaSCHEMBL18212456DTXSID00222482
Database identifiers
- CAS
7215-15-8- PubChem CID
- 23630
- DTXSID
DTXSID00222482- Nikkaji
- J84.694E
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 164
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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