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Substance Name: NSC 67613
RN: 37873-43-1
InChIKey: ONHBRYWYNVUGHT-LFYBBSHMSA-N

Molecular Formula

  • C8-H9-Br-N4

Molecular Weight

  • 241.091
 
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Names and Synonyms

  • NSC 67613

Registry Numbers

CAS Registry Number

  • 37873-43-1

System Generated Number

  • 0037873431

Structure Descriptors

InChI

1S/C8H9BrN4/c9-7-3-1-6(2-4-7)5-12-13-8(10)11/h1-5H,(H4,10,11,13)/b12-5+

InChIKey

ONHBRYWYNVUGHT-LFYBBSHMSA-N

Smiles

C(=N)(N\N=C\c1ccc(cc1)Br)N

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.3 (none)   EXP
Water Solubility 2060 mg/L 25 EST
Vapor Pressure 2.17E-05 mm Hg 25 EST
Henry's Law Constant 2.01E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.74E-11 cm3/molecule-sec 25 EST

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