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Substance Name: 6-Aminosulmazole
RN: 127356-05-2
InChIKey: VDFNDGBUMJWCPT-UHFFFAOYSA-N

Molecular Weight

  • 302.3566
 
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Names and Synonyms

  • 6-Aminosulmazole

Registry Numbers

CAS Registry Number

  • 127356-05-2

System Generated Number

  • 0127356052

Structure Descriptors

InChI

1S/C14H14N4O2S/c1-20-12-6-9(21(2)19)3-4-10(12)13-17-11-5-8(15)7-16-14(11)18-13/h3-7H,15H2,1-2H3,(H,16,17,18)

InChIKey

VDFNDGBUMJWCPT-UHFFFAOYSA-N

Smiles

COc1cc(ccc1c2[nH]c3cc(cnc3n2)N)S(=O)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.33 (none)   EXP
Water Solubility 6220 mg/L 25 EST
Vapor Pressure 4.48E-13 mm Hg 25 EST
Henry's Law Constant 1.42E-21 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.65E-10 cm3/molecule-sec 25 EST

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