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CAS No.: | 135577-57-0 |
---|---|
Name: | 2-Azido-1-methyl-6-phenylimidazo[4,5-b]pyridine |
Molecular Structure: | |
Formula: | C13H10N6 |
Molecular Weight: | 250.26 |
Synonyms: | Azido-phip;CCRIS 4000;2-Azido-1-methyl-6-phenyl-1H-imidazo[4,5-b]pyridine; |
PSA: | 80.46000 |
LogP: | 3.02986 |
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The 1H-Imidazo[4,5-b]pyridine,2-azido-1-methyl-6-phenyl- with CAS registry number of 135577-57-0 is also known as 2-Azido-1-methyl-6-phenyl-1H-imidazo[4,5-b]pyridine. The IUPAC name is 2-Azido-1-methyl-6-phenylimidazo[4,5-b]pyridine. It belongs to product categories of Detergents; Mutagenesis Research Chemicals. In addition, the formula is C13H10N6 and the molecular weight is 250.26.
Physical properties about 1H-Imidazo[4,5-b]pyridine,2-azido-1-methyl-6-phenyl- are: (1)ACD/LogP: 1.45; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 43.07Å2; (7)Exact Mass 250.096694; (8)MonoIsotopic Mass: 250.096694; (9)Topological Polar Surface Area: 45.1; (10)Heavy Atom Count: 19; (11)Complexity: 360; (12)Isotope Atom Count 0; (13)Undefined Bond StereoCenter Count: 1; (14)Covalently-Bonded Unit Count: 1.
You can still convert the following datas into molecular structure:
1. SMILES:[N-]=[N+]=N\c2nc1ncc(cc1n2C)c3ccccc3
2. InChI:InChI=1/C13H10N6/c1-19-11-7-10(9-5-3-2-4-6-9)8-15-12(11)16-13(19)17-18-14/h2-8H,1H3
3. InChIKey:FKTHQEHUMZTLTL-UHFFFAOYAE
4. Std. InChI:InChI=1S/C13H10N6/c1-19-11-7-10(9-5-3-2-4-6-9)8-15-12(11)16-13(19)17-18-14/h2-8H,1H3
5. Std. InChIKey:FKTHQEHUMZTLTL-UHFFFAOYSA-N