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Details

Stereochemistry RACEMIC
Molecular Formula C9H11NO2.ClH
Molecular Weight 201.65
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Amino-3-phenylpropanoic acid hydrochloride

SMILES

Cl.NC(CC(O)=O)C1=CC=CC=C1

InChI

InChIKey=ABEBCTCOPRULFS-UHFFFAOYSA-N
InChI=1S/C9H11NO2.ClH/c10-8(6-9(11)12)7-4-2-1-3-5-7;/h1-5,8H,6,10H2,(H,11,12);1H

HIDE SMILES / InChI

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

Molecular Formula C9H11NO2
Molecular Weight 165.1891
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:31:07 GMT 2025
Edited
by admin
on Wed Apr 02 17:31:07 GMT 2025
Record UNII
TU8NVU36VB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Amino-3-phenylpropanoic acid hydrochloride
Common Name English
3-phenyl-beta-alanine hydrochloride
Preferred Name English
Benzenepropanoic acid, ?-amino-, hydrochloride (1:1)
Systematic Name English
(DL)-3-Amino-3-phenylpropionic acid hydrochloride
Systematic Name English
(RS)-3-amino-3-phenyl-propionic acid hydrochloride
Systematic Name English
Benzenepropanoic acid, ?-amino-, hydrochloride
Systematic Name English
Code System Code Type Description
FDA UNII
TU8NVU36VB
Created by admin on Wed Apr 02 17:31:07 GMT 2025 , Edited by admin on Wed Apr 02 17:31:07 GMT 2025
PRIMARY
CAS
471259-71-9
Created by admin on Wed Apr 02 17:31:07 GMT 2025 , Edited by admin on Wed Apr 02 17:31:07 GMT 2025
PRIMARY
PUBCHEM
2868374
Created by admin on Wed Apr 02 17:31:07 GMT 2025 , Edited by admin on Wed Apr 02 17:31:07 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE