Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Methyl 2,5-dichlorobenzoate
RN: 2905-69-3
UNII: J07555O4HE
InChIKey: SPJQBGGHUDNAIC-UHFFFAOYSA-N

Molecular Formula

  • C8-H6-Cl2-O2

Molecular Weight

  • 205.039
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Methyl 2,5-dichlorobenzoate

Synonyms

  • Benzoic acid, 2,5-dichloro-, methyl ester
  • EINECS 220-815-7
  • HSDB 5903
  • Methyl 2,5-dichlorobenzoate
  • Methyl-2,5-dichlorobenzoate
  • UNII-J07555O4HE

Systematic Names

  • Benzoic acid, 2,5-dichloro-, methyl ester
  • Methyl 2,5-dichlorobenzoate

Registry Numbers

CAS Registry Number

  • 2905-69-3

FDA UNII

  • J07555O4HE

System Generated Number

  • 0002905693

Structure Descriptors

InChI

1S/C8H6Cl2O2/c1-12-8(11)6-4-5(9)2-3-7(6)10/h2-4H,1H3

InChIKey

SPJQBGGHUDNAIC-UHFFFAOYSA-N

Smiles

c1(c(ccc(c1)Cl)Cl)C(OC)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 37-40 deg C   EXP
log P (octanol-water) 3.120 (none)   EST
Water Solubility 89.8 mg/L 25 EST
Vapor Pressure 0.012 mm Hg 25 EST
Henry's Law Constant 1.91E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.46E-13 cm3/molecule-sec 25 EST

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