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Substance Name: Propanoic acid, 2-chloro-, 1-methylethyl ester
RN: 40058-87-5
InChIKey: BOKVSRHWZPCJRN-UHFFFAOYSA-N

Molecular Formula

  • C6-H11-Cl-O2

Molecular Weight

  • 150.604
 
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Names and Synonyms

Synonyms

  • AI3-33780
  • EINECS 254-777-8
  • Isopropyl 2-chloropropionate

Systematic Names

  • Isopropyl 2-chloropropionate
  • Propanoic acid, 2-chloro-, 1-methylethyl ester

Registry Numbers

CAS Registry Number

  • 40058-87-5

System Generated Number

  • 0040058875

Structure Descriptors

InChI

1S/C6H11ClO2/c1-4(2)9-6(8)5(3)7/h4-5H,1-3H3

InChIKey

BOKVSRHWZPCJRN-UHFFFAOYSA-N

Smiles

C([C@@H](C)Cl)(=O)OC(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 151.5 deg C   EXP
log P (octanol-water) 1.950 (none)   EST
Atmospheric OH Rate Constant 2.55E-12 cm3/molecule-sec 25 EST

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