Basic information
- CAS
64286-84-6- Standard SMILES
O=C(N[C@@H](Cc1ccccc1)C(=O)OC(Cl)CCl)OCc1ccccc1- InChIKey
KQUMDRSFGJYKSZ-BHWOMJMDSA-N- Molecular formula
- C19H19Cl2NO4
- Average molar mass
- 396.3 g/mol
- Monoisotopic mass
- 395.0691135
Names & identifiers
- Preferred name
- Alanine, N-benzyloxycarbonyl-3-phenyl-, 1,2-dichloroethyl ester, L-
- IUPAC
- 1,2-dichloroethyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
- English name
- N-(Benzyloxycarbonyl)-L-phenylalanine 1,2-dichloroethyl ester
- Molecular formula
- C19H19Cl2NO4
- Molecular weight
- 396.26
Names & synonyms
BRN 278143264286-84-6N-Carbobenzoxy-L-phenylalanine 1,2-dichloroethyl esterL-N-Benzyloxycarbonyl-3-phenylalanine 1,2-dichloroethyl esterALANINE, N-BENZYLOXYCARBONYL-3-PHENYL-, 1,2-DICHLOROETHYL ESTER, L-RefChem:318018CHEMBL3276002DTXSID60982838N-(Benzyloxycarbonyl)-L-phenylalanine 1,2-dichloroethyl esterDB-3087141,2-Dichloroethyl N-[(benzyloxy)(hydroxy)methylidene]phenylalaninate1,2-Dichloroethyl N-[(benzyloxy)(hydroxy)methylidene]-L-phenylalaninate
Show more names
L-Phenylalanine, N-[(phenylmethoxy)carbonyl]-, 1,2-dichloroethyl ester
Database identifiers
- CAS
64286-84-6- PubChem CID
- 47331
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 437
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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