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Substance Name: 3-Chlorophthalic acid
RN: 27563-65-1
InChIKey: BKFXSOCDAQACQM-UHFFFAOYSA-N

Molecular Formula

  • C8-H5-Cl-O4

Molecular Weight

  • 200.577
 
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Names and Synonyms

Synonym

  • EINECS 248-527-7

Systematic Name

  • 3-Chlorophthalic acid

Registry Numbers

CAS Registry Number

  • 27563-65-1

System Generated Number

  • 0027563651

Structure Descriptors

InChI

1S/C8H5ClO4/c9-5-3-1-2-4(7(10)11)6(5)8(12)13/h1-3H,(H,10,11)(H,12,13)

InChIKey

BKFXSOCDAQACQM-UHFFFAOYSA-N

Smiles

c1(c(C(=O)O)cccc1Cl)C(=O)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.720 (none)   EST
Water Solubility 2.12E+04 mg/L 14 EXP
Atmospheric OH Rate Constant 1.18E-12 cm3/molecule-sec 25 EST

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