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Substance Name: Ethyl 3-chlorobenzoate
RN: 1128-76-3
InChIKey: LVFRSNCBCHABAM-UHFFFAOYSA-N

Molecular Formula

  • C9-H9-Cl-O2

Molecular Weight

  • 184.621
 
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Names and Synonyms

Synonyms

  • AI3-11590
  • EINECS 214-441-3

Systematic Names

  • Benzoic acid, 3-chloro-, ethyl ester
  • Ethyl 3-chlorobenzoate

Registry Numbers

CAS Registry Number

  • 1128-76-3

System Generated Number

  • 0001128763

Structure Descriptors

InChI

1S/C9H9ClO2/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3

InChIKey

LVFRSNCBCHABAM-UHFFFAOYSA-N

Smiles

Clc1cccc(c1)C(=O)OCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 243 deg C   EXP
log P (octanol-water) 2.960 (none)   EST
Atmospheric OH Rate Constant 1.97E-12 cm3/molecule-sec 25 EST

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