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Substance Name: Diflumetorim [ISO]
RN: 130339-07-0
InChIKey: NEKULYKCZPJMMJ-UHFFFAOYSA-N

Molecular Formula

  • C15-H16-Cl-F2-N3-O

Molecular Weight

  • 327.7604
 
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Names and Synonyms

Name of Substance

  • Diflumetorim [ISO]

Synonym

  • Diflumetorim

Registry Numbers

CAS Registry Number

  • 130339-07-0

System Generated Number

  • 0130339070

Structure Descriptors

InChI

1S/C15H16ClF2N3O/c1-3-12(21-14-13(16)9(2)19-8-20-14)10-4-6-11(7-5-10)22-15(17)18/h4-8,12,15H,3H2,1-2H3,(H,19,20,21)

InChIKey

NEKULYKCZPJMMJ-UHFFFAOYSA-N

Smiles

c1(ncnc(N[C@@H](CC)c2ccc(cc2)OC(F)F)c1Cl)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 47.3 deg C   EXP
pKa Dissociation Constant 4.5 (none)   EXP
Water Solubility 33 mg/L   EXP
Vapor Pressure 2.41E-06 mm Hg 25 EXP
Henry's Law Constant 3.15E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.00E-11 cm3/molecule-sec 25 EST

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