Product Name: 4-Amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene (CAS NO.78859-36-6)
Molecular Formula: C13H11N5
Molecular Weight: 237.29g/mol
Mol File: 78859-36-6.mol
Boiling point: 431.4 °C at 760 mmHg
Flash Point: 214.7 °C
Density: 1.59 g/cm3
Surface Tension: 70 dyne/cm
Enthalpy of Vaporization: 68.7 kJ/mol
Vapour Pressure: 1.2E-07 mmHg at 25°C
XLogP3-AA: 0.9
H-Bond Donor: 1
H-Bond Acceptor: 4
Structure Descriptors of 4-Amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene (CAS NO.78859-36-6):
Canonical SMILES: CC1=NC(=C2C=NCN3C2=C1C4=C3N=CC=C4)N
InChI: InChI=1S/C13H11N5/c1-7-10-8-3-2-4-16-13(8)18-6-15-5-9(11(10)18)12(14)17-7/h2-5H,6H2,1H3,(H2,14,17)
InChIKey: NZLRKRKOVVXDLV-UHFFFAOYSA-N
1. | mic-sat 500 ng/plate | CPBTAL Chemical and Pharmaceutical Bulletin. 29 (1981),1473. | ||
2. | mic-sat 1 nmol/plate/20M | EMMUEG Environmental and Molecular Mutagenesis. 38 (2001),268. |
Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
4-Amino-6-methyl-1H-2,5,10,10b-tetraazafluoranthene , its CAS NO. is 78859-36-6, the synonyms are BRN 5755713 ; Orn-P-1 ; 1H-2,5,10,10b-Tetraazafluoranthene, 4-amino-6-methyl- ; 6H-2,5,6a,7-Tetraazafluoranthen-3-amine, 1-methyl- .
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