Basic information
- CAS
62664-95-3- Standard SMILES
O=C(O)C1CCN1CCc1ccccc1- InChIKey
UXXKTOACZVPMFC-UHFFFAOYSA-N- Molecular formula
- C12H15NO2
- Average molar mass
- 205.25 g/mol
- Monoisotopic mass
- 205.11027872
Names & identifiers
- Preferred name
- 1-(2-Phenylethyl)azetidine-2-carboxylic acid
- IUPAC
- 1-(2-phenylethyl)azetidine-2-carboxylic acid
- English name
- 1-(2-Phenylethyl)-2-azetidinecarboxylic acid
- Molecular formula
- C12H15NO2
- Molecular weight
- 205.25
Names & synonyms
62664-95-31-(2-Phenylethyl)azetidine-2-carboxylic acid1-phenethylazetidine-2-carboxylic Acid1-(2-PHENYLETHYL)-2-AZETIDINECARBOXYLIC ACIDSCHEMBL5685811DTXSID004046601-phenethylazetidine-2-carboxylicAcidMB04255DB-3627461-PHENETHYL-AZETIDINE-2-CARBOXYLIC ACID2-Azetidinecarboxylic acid, 1-(2-phenylethyl)-
Database identifiers
- CAS
62664-95-3- PubChem CID
- 4592907
- DTXSID
DTXSID00404660
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 224
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers2 total
Alfa Chemistry+1-5166625404 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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