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Substance Name: Cyclopropanecarboxylic acid, 1-((4-methylphenyl)sulfonyl)-, ethyl ester
RN: 145348-20-5
InChIKey: WPUICWRULLWSQY-UHFFFAOYSA-N

Molecular Formula

  • C13-H16-O4-S

Molecular Weight

  • 268.331
 
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Names and Synonyms

Synonym

  • Ethyl 1-((4-methylphenyl)sulfonyl)cyclopropanecarboxylate

Systematic Name

  • Cyclopropanecarboxylic acid, 1-((4-methylphenyl)sulfonyl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 145348-20-5

System Generated Number

  • 0145348205

Structure Descriptors

InChI

1S/C13H16O4S/c1-3-17-12(14)13(8-9-13)18(15,16)11-6-4-10(2)5-7-11/h4-7H,3,8-9H2,1-2H3

InChIKey

WPUICWRULLWSQY-UHFFFAOYSA-N

Smiles

c1cc(C)ccc1S(=O)(=O)C1(C(=O)OCC)CC1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 75.5 deg C   EXP
log P (octanol-water) 2.23 (none)   EXP
Water Solubility 262 mg/L 25 EXP
Vapor Pressure 2.97E-06 mm Hg 25 EST
Henry's Law Constant 3.38E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.94E-12 cm3/molecule-sec 25 EST

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