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Substance Name: Isobutylmalonic acid
RN: 4361-06-2
InChIKey: FTKIARCSSZWRFJ-UHFFFAOYSA-N

Molecular Formula

  • C7-H12-O4

Molecular Weight

  • 160.168
 
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Names and Synonyms

Synonym

  • EINECS 224-444-1

Systematic Name

  • Isobutylmalonic acid

Registry Numbers

CAS Registry Number

  • 4361-06-2

System Generated Number

  • 0004361062

Structure Descriptors

InChI

1S/C7H12O4/c1-4(2)3-5(6(8)9)7(10)11/h4-5H,3H2,1-2H3,(H,8,9)(H,10,11)

InChIKey

FTKIARCSSZWRFJ-UHFFFAOYSA-N

Smiles

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

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 112 dec deg C   EXP
log P (octanol-water) 0.570 (none)   EST
Atmospheric OH Rate Constant 6.52E-12 cm3/molecule-sec 25 EST

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