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Details

Stereochemistry RACEMIC
Molecular Formula C11H13NO3.ClH
Molecular Weight 243.687
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl β-oxo-DL-phenylalaninate hydrochloride

SMILES

Cl.CCOC(=O)C(N)C(=O)C1=CC=CC=C1

InChI

InChIKey=GPZDAOXGEAACMN-UHFFFAOYSA-N
InChI=1S/C11H13NO3.ClH/c1-2-15-11(14)9(12)10(13)8-6-4-3-5-7-8;/h3-7,9H,2,12H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula C11H13NO3
Molecular Weight 207.2258
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:12:59 GMT 2023
Edited
by admin
on Sat Dec 16 19:12:59 GMT 2023
Record UNII
F2D5QS6LU2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethyl β-oxo-DL-phenylalaninate hydrochloride
Systematic Name English
Phenylalanine, β-oxo-, ethyl ester, hydrochloride (1:1)
Systematic Name English
Phenylalanine, β-oxo-, ethyl ester, hydrochloride
Systematic Name English
DL-Phenylalanine, β-oxo-, ethyl ester, hydrochloride
Systematic Name English
Code System Code Type Description
PUBCHEM
24193015
Created by admin on Sat Dec 16 19:12:59 GMT 2023 , Edited by admin on Sat Dec 16 19:12:59 GMT 2023
PRIMARY
FDA UNII
F2D5QS6LU2
Created by admin on Sat Dec 16 19:12:59 GMT 2023 , Edited by admin on Sat Dec 16 19:12:59 GMT 2023
PRIMARY
CAS
107438-51-7
Created by admin on Sat Dec 16 19:12:59 GMT 2023 , Edited by admin on Sat Dec 16 19:12:59 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE