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Substance Name: 3,7-Dinitro-5-oxophenothiazine
RN: 574-81-2
UNII: 4750596FET
InChIKey: VCYRBORHWHUNIK-UHFFFAOYSA-N

Molecular Formula

  • C12-H7-N3-O5-S

Molecular Weight

  • 305.269
 
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Names and Synonyms

Name of Substance

  • 3,7-Dinitro-5-oxophenothiazine

Synonyms

  • EINECS 209-375-7
  • NSC 18426
  • UNII-4750596FET

Systematic Name

  • 3,7-Dinitrophenothiazine 5-oxide

Registry Numbers

CAS Registry Number

  • 574-81-2

FDA UNII

  • 4750596FET

System Generated Number

  • 0000574812

Structure Descriptors

InChI

1S/C12H7N3O5S/c16-14(17)7-1-3-9-11(5-7)21(20)12-6-8(15(18)19)2-4-10(12)13-9/h1-6,13H

InChIKey

VCYRBORHWHUNIK-UHFFFAOYSA-N

Smiles

S1(c2cc([N+]([O-])=O)ccc2Nc2c1cc([N+]([O-])=O)cc2)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.240 (none)   EST
Atmospheric OH Rate Constant 6.78E-11 cm3/molecule-sec 25 EST

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