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Substance Name: Benzoic acid, 2,4,5-trimethoxy-
RN: 490-64-2
InChIKey: KVZUCOGWKYOPID-UHFFFAOYSA-N

Molecular Formula

  • C10-H12-O5

Molecular Weight

  • 212.2
 
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Names and Synonyms

Synonyms

  • 2,4,5-Trimethoxybenzoic acid
  • AI3-38428
  • EINECS 207-715-9

Systematic Names

  • 2,4,5-Trimethoxybenzoic acid
  • Benzoic acid, 2,4,5-trimethoxy-

Registry Numbers

CAS Registry Number

  • 490-64-2

System Generated Number

  • 0000490642

Structure Descriptors

InChI

1S/C10H12O5/c1-13-7-5-9(15-3)8(14-2)4-6(7)10(11)12/h4-5H,1-3H3,(H,11,12)

InChIKey

KVZUCOGWKYOPID-UHFFFAOYSA-N

Smiles

c1(c(cc(OC)c(c1)OC)OC)C(O)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 145 deg C   EXP
Boiling Point 300 deg C   EXP
log P (octanol-water) 1.260 (none)   EST
Atmospheric OH Rate Constant 7.90E-11 cm3/molecule-sec 25 EST

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