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Substance Name: Butanoic acid, 3-methyl-, hydrazide (9CI)
RN: 24310-18-7
InChIKey: OQNKZWDYYSHLPO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C5-H12-N2-O

Molecular Weight

  • 116.163
 
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Names and Synonyms

Synonyms

  • 3-Methylbutanoic acid hydrazide
  • 4-02-00-00903 (Beilstein Handbook Reference)
  • BRN 1700750
  • Isobutylcarbonyl hydrazine
  • Isovaleriansaeurehydrazid
  • Isovaleriansaeurehydrazid [German]
  • Isovaleric hydrazide
  • Isovalerohydrazide
  • NSC 523270

Systematic Names

  • Butanoic acid, 3-methyl-, hydrazide (9CI)
  • Isovaleric acid, hydrazide

Registry Numbers

CAS Registry Number

  • 24310-18-7

System Generated Number

  • 0024310187

Structure Descriptors

InChI

1S/C5H12N2O/c1-4(2)3-5(8)7-6/h4H,3,6H2,1-2H3,(H,7,8)

InChIKey

OQNKZWDYYSHLPO-UHFFFAOYSA-N

Smiles

C(CC(C)C)(NN)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 337mg/kg (337mg/kg)   Acta Biologica et Medica Germanica. Vol. 21, Pg. 635, 1968.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.31 (none)   EXP
Water Solubility 9340 mg/L 25 EST
Vapor Pressure 4.30E-03 mm Hg 25 EST
Henry's Law Constant 1.09E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.43E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.