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Substance Name: Cyclopropanecarboxylic acid, 1-((4-methylphenyl)sulfonyl)-, 1-methylethyl ester
RN: 145348-21-6
InChIKey: RHDLXXXPRNASTE-UHFFFAOYSA-N

Molecular Formula

  • C14-H18-O4-S

Molecular Weight

  • 282.3582
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 145348-21-6

System Generated Number

  • 0145348216

Structure Descriptors

InChI

1S/C14H18O4S/c1-10(2)18-13(15)14(8-9-14)19(16,17)12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3

InChIKey

RHDLXXXPRNASTE-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)S(=O)(=O)C2(CC2)C(=O)OC(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 65.5 deg C   EXP
log P (octanol-water) 2.52 (none)   EXP
Water Solubility 166 mg/L 25 EXP
Vapor Pressure 2.24E-06 mm Hg 25 EST
Henry's Law Constant 4.49E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.72E-12 cm3/molecule-sec 25 EST

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