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Substance Name: Butanoic acid, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-
RN: 13403-01-5
InChIKey: PHCYXPLSQNMCRY-UHFFFAOYSA-N

Molecular Formula

  • C20-H32-O3

Molecular Weight

  • 320.4698
 
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Names and Synonyms

Synonyms

  • 2-(2,4-Di-tert-pentylphenoxy)butyric acid
  • EINECS 236-495-7

Systematic Names

  • 2-(2,4-Bis(tert-pentyl)phenoxy)butyric acid
  • Butanoic acid, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-
  • Butyric acid, 2-(2,4-di-tert-pentylphenoxy)-

Registry Numbers

CAS Registry Number

  • 13403-01-5

System Generated Number

  • 0013403015

Structure Descriptors

InChI

1S/C20H32O3/c1-8-16(18(21)22)23-17-12-11-14(19(4,5)9-2)13-15(17)20(6,7)10-3/h11-13,16H,8-10H2,1-7H3,(H,21,22)

InChIKey

PHCYXPLSQNMCRY-UHFFFAOYSA-N

Smiles

CCC(C(=O)O)Oc1ccc(cc1C(C)(C)CC)C(C)(C)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 skin > 20mL/kg (20mL/kg)   Kodak Company Reports. Vol. 21MAY1971,
rat LD50 intraperitoneal 400mg/kg (400mg/kg)   Kodak Company Reports. Vol. 21MAY1971,
rat LD50 oral > 3200mg/kg (3200mg/kg)   Kodak Company Reports. Vol. 21MAY1971,