2-Azido-3,7,8-trimethyl-3H-imidazo[4,5-f]quinoxaline supplier

Name
2-Azido-3,7,8-trimethyl-3H-imidazo[4,5-f]quinoxaline
EINECS
CAS No. 210100-59-7
Density
Solubility
Melting Point
Formula C₁₂H₁₁N₇
Boiling Point
Molecular Weight 253.26
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Azido-7,8-DiMeIQx;
PSA 93.35000
LogP 2.52786

2-Azido-3,7,8-trimethyl-3H-imidazo[4,5-f]quinoxaline Specification

The IUPAC name of this chemical is 2-Azido-3,7,8-trimethyl-3H-imidazo[4,5-f]quinoxaline. The CAS registry number is 210100-59-7. In addition, the molecular formula is C₁₂H₁₁N₇ and the molecular weight is 253.26. It belongs to the classes of Isotope Labeled Compounds and Mutagenesis Research Chemicals. And it can be used as a novel analog of the food mutagen.

Physical properties about 2-Azido-3,7,8-trimethyl-3H-imidazo[4,5-f]quinoxaline are: (1)ACD/LogP: 1.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.17; (4)ACD/LogD (pH 7.4): 1.17; (5)ACD/BCF (pH 5.5): 4.58; (6)ACD/BCF (pH 7.4): 4.58; (7)ACD/KOC (pH 5.5): 103.51; (8)ACD/KOC (pH 7.4): 103.51; (9)#H bond acceptors: 7; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 55.96 Å².

You can still convert the following datas into molecular structure:
(1)SMILES: [N-]=[N+]=N\c3nc2c1nc(c(nc1ccc2n3C)C)C
(2)InChI: InChI=1/C12H11N7/c1-6-7(2)15-10-8(14-6)4-5-9-11(10)16-12(17-18-13)19(9)3/h4-5H,1-3H3
(3)InChIKey: IJDGZXLRDRKKGV-UHFFFAOYAA

Product Name

2-Azido-3,7,8-trimethyl-3H-imidazo[4,5-f]quinoxaline

2-Azido-3,7,8-trimethyl-3H-imidazo[4,5-f]quinoxaline Specification

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