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Substance Name: (1,1'-Biphenyl)-4-acetic acid, alpha-(1-hydroxy-1-phenylethyl)-, (R*,S*)-(-)-
RN: 85045-63-2
InChIKey: DPYOMKYUWLNESO-IRLDBZIGSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H20-O3

Molecular Weight

  • 332.397
 
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Names and Synonyms

Synonym

  • (R*,S*)-(-)-alpha-(1-Hydroxy-1-phenylethyl)-(1,1'-biphenyl)-4-acetic acid

Systematic Name

  • (1,1'-Biphenyl)-4-acetic acid, alpha-(1-hydroxy-1-phenylethyl)-, (R*,S*)-(-)-

Registry Numbers

CAS Registry Number

  • 85045-63-2

System Generated Number

  • 0085045632

Structure Descriptors

InChI

1S/C22H20O3/c1-22(25,19-10-6-3-7-11-19)20(21(23)24)18-14-12-17(13-15-18)16-8-4-2-5-9-16/h2-15,20,25H,1H3,(H,23,24)/t20-,22+/m1/s1

InChIKey

DPYOMKYUWLNESO-IRLDBZIGSA-N

Smiles

C[C@](c1ccccc1)([C@H](c2ccc(cc2)c3ccccc3)C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 17, Pg. 509, 1982.