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Details

Stereochemistry ABSOLUTE
Molecular Formula C10H13NO2.ClH
Molecular Weight 215.677
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-AMINO-3-PHENYLBUTYRIC ACID HYDROCHLORIDE, (R)-

SMILES

Cl.NC[C@H](CC(O)=O)C1=CC=CC=C1

InChI

InChIKey=XSYRYMGYPBGOPS-FVGYRXGTSA-N
InChI=1S/C10H13NO2.ClH/c11-7-9(6-10(12)13)8-4-2-1-3-5-8;/h1-5,9H,6-7,11H2,(H,12,13);1H/t9-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C10H13NO2
Molecular Weight 179.2157
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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 10:05:31 UTC 2023
Edited
by admin
on Sat Dec 16 10:05:31 UTC 2023
Record UNII
LX088BE850
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-AMINO-3-PHENYLBUTYRIC ACID HYDROCHLORIDE, (R)-
Common Name English
BENZENEPROPANOIC ACID, .BETA.-(AMINOMETHYL)-, HYDROCHLORIDE (1:1), (.BETA.R)-
Systematic Name English
(R)-4-AMINO-3-PHENYLBUTYRIC ACID HYDROCHLORIDE
Systematic Name English
(-)-4-AMINO-3-PHENYLBUTYRIC ACID HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
25022898
Created by admin on Sat Dec 16 10:05:31 UTC 2023 , Edited by admin on Sat Dec 16 10:05:31 UTC 2023
PRIMARY
FDA UNII
LX088BE850
Created by admin on Sat Dec 16 10:05:31 UTC 2023 , Edited by admin on Sat Dec 16 10:05:31 UTC 2023
PRIMARY
CAS
52992-48-0
Created by admin on Sat Dec 16 10:05:31 UTC 2023 , Edited by admin on Sat Dec 16 10:05:31 UTC 2023
PRIMARY