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Substance Name: Butyric acid, 4-amino-2-phenyl-, hydrochloride
RN: 66859-48-1
InChIKey: ANXJUMSUOAYSNF-UHFFFAOYSA-N

Molecular Formula

  • C10-H13-N-O2.Cl-H

Molecular Weight

  • 215.679
 
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Names and Synonyms

Synonym

  • (4-Amino-2-phenyl)butyrate hydrochloride

Systematic Name

  • Butyric acid, 4-amino-2-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 66859-48-1

Related Registry Number

  • 13080-10-9 (Parent)

System Generated Number

  • 0066859481

Molecular Formulas

Molecular Formula

  • C10-H13-N-O2.Cl-H

Molecular Formula Fragments

  • C10-H13-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C10H13NO2.ClH/c11-7-6-9(10(12)13)8-4-2-1-3-5-8;/h1-5,9H,6-7,11H2,(H,12,13);1H

InChIKey

ANXJUMSUOAYSNF-UHFFFAOYSA-N

Smiles

c1([C@@H](CC[NH3+])C(O)=O)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2gm/kg (2000mg/kg)   Journal of Medicinal Chemistry. Vol. 6, Pg. 539, 1963.