Acetic acid, 2-amino-2-phenyl-, 3-pentyl ester, hydrochloride
Basic information
- CAS
73623-42-4- Standard SMILES
CCC(CC)OC(=O)C([NH3+])c1ccccc1.[Cl-]- InChIKey
BNNQIDDJHIXHDQ-UHFFFAOYSA-N- Molecular formula
- C13H20ClNO2
- Average molar mass
- 257.75 g/mol
- Monoisotopic mass
- 257.1182566
Names & identifiers
- Preferred name
- Acetic acid, 2-amino-2-phenyl-, 3-pentyl ester, hydrochloride
- IUPAC
- (2-oxo-2-pentan-3-yloxy-1-phenylethyl)azanium chloride
Names & synonyms
73623-42-4ACETIC ACID, 2-AMINO-2-PHENYL-, 3-PENTYL ESTER, HYDROCHLORIDERefChem:10757462-Amino-2-phenylacetic acid 3-pentyl ester hydrochloridealpha-Amino-phenylessigsaeure-isoamylester hydrochlorid [German]alpha-Amino-phenylessigsaeure-isoamylester hydrochlorid
Database identifiers
- CAS
73623-42-4- PubChem CID
- 51930
Properties
Computed structural properties
- Topological polar surface area
- 53.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 208
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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