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Substance Name: Uracil, 3-(4-butoxy-3-chlorobenzyl)-5-fluoro-
RN: 102613-18-3
InChIKey: GJGKTZHGBJGHBY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H16-Cl-F-N2-O3

Molecular Weight

  • 326.7534
 
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Names and Synonyms

Synonym

  • 3-(3-Chloro-4-butoxybenzyl)-5-fluorouracil

Systematic Name

  • Uracil, 3-(4-butoxy-3-chlorobenzyl)-5-fluoro-

Registry Numbers

CAS Registry Number

  • 102613-18-3

System Generated Number

  • 0102613183

Structure Descriptors

InChI

1S/C15H16ClFN2O3/c1-2-3-6-22-13-5-4-10(7-11(13)16)9-19-14(20)12(17)8-18-15(19)21/h4-5,7-8H,2-3,6,9H2,1H3,(H,18,21)

InChIKey

GJGKTZHGBJGHBY-UHFFFAOYSA-N

Smiles

CCCCOc1ccc(cc1Cl)Cn2c(=O)c(c[nH]c2=O)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1200mg/kg (1200mg/kg)   Pharmaceutical Chemistry Journal Vol. 12, Pg. 586, 1978.