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Details

Stereochemistry RACEMIC
Molecular Formula C10H12N2O4.ClH
Molecular Weight 260.674
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Nitro-DL-phenylalanine methyl ester hydrochloride

SMILES

Cl.COC(=O)C(N)CC1=CC=C(C=C1)[N+]([O-])=O

InChI

InChIKey=BTHMRXRBXYHLRA-UHFFFAOYSA-N
InChI=1S/C10H12N2O4.ClH/c1-16-10(13)9(11)6-7-2-4-8(5-3-7)12(14)15;/h2-5,9H,6,11H2,1H3;1H

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1-Methoxy-3-(4-nitrophenyl)-1-oxopropan-2-aminium chloride
Preferred Name English
4-Nitro-DL-phenylalanine methyl ester hydrochloride
Systematic Name English
Methyl 2-amino-3-(4-nitrophenyl)propanoate hydrochloride
Systematic Name English
DL-Phenylalanine, 4-nitro-, methyl ester, monohydrochloride
Systematic Name English
Phenylalanine, 4-nitro-, methyl ester, hydrochloride (1:1)
Systematic Name English
4-Nitrophenylalanine methyl ester hydrochloride
Systematic Name English
Phenylalanine, 4-nitro-, methyl ester, monohydrochloride
Systematic Name English
Code System Code Type Description
PUBCHEM
53395976
Created by admin on Wed Apr 02 19:23:05 GMT 2025 , Edited by admin on Wed Apr 02 19:23:05 GMT 2025
PRIMARY
FDA UNII
4DLX32VHT9
Created by admin on Wed Apr 02 19:23:05 GMT 2025 , Edited by admin on Wed Apr 02 19:23:05 GMT 2025
PRIMARY
CAS
108450-75-5
Created by admin on Wed Apr 02 19:23:05 GMT 2025 , Edited by admin on Wed Apr 02 19:23:05 GMT 2025
PRIMARY
NIH
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