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Substance Name: Pentanoic acid, 2,2,4,4-tetramethyl-, 1-naphthalenyl ester
RN: 35231-91-5
InChIKey: PVHHAAWDOLTBIR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H24-O2

Molecular Weight

  • 284.397
 
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Names and Synonyms

Synonyms

  • 1-Naphthalenyl 2,2,4,4-tetramethylpentanoate
  • BRN 2284133
  • Valeric acid, 2,2,4,4-tetramethyl-, 1-naphthyl ester

Systematic Name

  • Pentanoic acid, 2,2,4,4-tetramethyl-, 1-naphthalenyl ester

Registry Numbers

CAS Registry Number

  • 35231-91-5

System Generated Number

  • 0035231915

Structure Descriptors

InChI

1S/C19H24O2/c1-18(2,3)13-19(4,5)17(20)21-16-12-8-10-14-9-6-7-11-15(14)16/h6-12H,13H2,1-5H3

InChIKey

PVHHAAWDOLTBIR-UHFFFAOYSA-N

Smiles

C(C(CC(C)(C)C)(C)C)(=O)Oc1cccc2ccccc12

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 2gm/kg (2000mg/kg)   Chimica Therapeutica. Vol. 6, Pg. 403, 1971.