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Substance Name: (4-Chloro-2-fluoro-5-propan-2-yloxycarbonylphenyl)pyrrolidine-1-carboxylate
RN: 133636-98-3
InChIKey: ZNZSIWMFOKUCMG-UHFFFAOYSA-N

Molecular Weight

  • 329.753
 
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Names and Synonyms

  • (4-Chloro-2-fluoro-5-propan-2-yloxycarbonylphenyl)pyrrolidine-1-carboxylate

Registry Numbers

CAS Registry Number

  • 133636-98-3

System Generated Number

  • 0133636983

Structure Descriptors

InChI

1S/C15H17ClFNO4/c1-9(2)21-14(19)10-7-13(12(17)8-11(10)16)22-15(20)18-5-3-4-6-18/h7-9H,3-6H2,1-2H3

InChIKey

ZNZSIWMFOKUCMG-UHFFFAOYSA-N

Smiles

Fc1cc(Cl)c(C(=O)OC(C)C)cc1OC(=O)N1CCCC1

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 4.22 (none)   EXP
Water Solubility 2.040 mg/L 25 EST
Vapor Pressure 1.68E-05 mm Hg 25 EST
Henry's Law Constant 5.38E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.01E-11 cm3/molecule-sec 25 EST

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