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N-Benzyloxycarbonyl-DL-phenylalanine vinyl ester

HCID 47329
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Basic information

CAS
64187-42-4
Standard SMILES
C=COC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1
InChIKey
XCGDYLANQZQVNE-UHFFFAOYSA-N
Molecular formula
C19H19NO4
Average molar mass
325.4 g/mol
Monoisotopic mass
325.13140809

Names & identifiers

Preferred name
N-Benzyloxycarbonyl-DL-phenylalanine vinyl ester
IUPAC
ethenyl 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Names & synonyms

EQC4JKQ5XF64286-81-3N-Benzyloxycarbonyl-DL-phenylalanine vinyl esterRefChem:1091624N-Carbobenzoxy-L-phenylalanine vinyl ester64187-42-4N-((Phenylmethoxy)carbonyl)-L-phenylalanine ethenyl esterL-Phenylalanine, N-((phenylmethoxy)carbonyl)-, ethenyl esterNSC-347521DL-N-Benzyloxycarbonyl-3-phenylalanine vinyl esterL-N-Carboxy-3-phenylalanine N-benzyl 1-vinyl esterAlanine, N-benzyloxycarbonyl-3-phenyl-, vinyl ester, L-
Show more names
Alanine, N-carboxy-3-phenyl-, N-benzyl 1-vinyl ester, L-ALANINE, N-BENZYLOXYCARBONYL-3-PHENYL-, VINYL ESTER, DL-L-Phenylalanine, ethenyl esterCHEMBL3275990DL-Phenylalanine, N-[(phenylmethoxy)carbonyl]-, ethenyl esterNSC347521NSC 347521N-[(Phenylmethoxy)carbonyl]phenylalanine ethenyl ester

Database identifiers

CAS
64187-42-4、64286-81-3
PubChem CID
47329
ChEMBL
CHEMBL3275990
UNII
EQC4JKQ5XF

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
24
Formal charge
0
Complexity
412

Related reactions

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Compound notes

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