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Substance Name: Suberic acid
RN: 505-48-6
UNII: 6U7Y4M9C1H
InChIKey: TYFQFVWCELRYAO-UHFFFAOYSA-N

Note

  • Used in plastics industry; inhibits activity of some enzymes.

Molecular Formula

  • C8-H14-O4

Molecular Weight

  • 174.1946
 
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Names and Synonyms

Name of Substance

  • Suberic acid

Synonyms

  • 1,6-Hexanedicarboxylic acid
  • 1,8-Octanedioic acid
  • AI3-52672
  • EINECS 208-010-9
  • Hexamethylenedicarboxylic acid
  • NSC 25952
  • Octanedioic acid
  • Suberic acid
  • UNII-6U7Y4M9C1H

Systematic Names

  • Octanedioic acid
  • Suberic acid

Registry Numbers

CAS Registry Number

  • 505-48-6

FDA UNII

  • 6U7Y4M9C1H

System Generated Number

  • 0000505486

Structure Descriptors

InChI

1S/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12)

InChIKey

TYFQFVWCELRYAO-UHFFFAOYSA-N

Smiles

C(CCCCCCC(O)=O)(O)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 144 deg C   EXP
Boiling Point 345.5 deg C   EXP
pKa Dissociation Constant 4.52 (none) 25 EXP
log P (octanol-water) 1.210 (none)   EST
Water Solubility 1.19E+04 mg/L 25 EXP
Henry's Law Constant 1.68E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.42E-12 cm3/molecule-sec 25 EST

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