Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,3,4,6,7,9,9b-Heptaazaphenalene-2,5,8(1H,3H,6H)-trione
RN: 1502-46-1
InChIKey: PBKYCCOBOHDCIT-UHFFFAOYSA-N

Molecular Formula

  • C6-H3-N7-O3

Molecular Weight

  • 221.1357
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • NSC 156433

Systematic Name

  • 1,3,4,6,7,9,9b-Heptaazaphenalene-2,5,8(1H,3H,6H)-trione

Registry Numbers

CAS Registry Number

  • 1502-46-1

System Generated Number

  • 0001502461

Structure Descriptors

InChI

1S/C6H3N7O3/c14-4-7-1-8-5(15)10-3-12-6(16)11-2(9-4)13(1)3/h(H3,7,8,9,10,11,12,14,15,16)

InChIKey

PBKYCCOBOHDCIT-UHFFFAOYSA-N

Smiles

c12[nH]c(=O)nc3n1c(nc(=O)n2)NC(=O)N3

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -6.560 (none)   EST
Water Solubility 2400 mg/L 17 EXP
Atmospheric OH Rate Constant 9.00E-12 cm3/molecule-sec 25 EST

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