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1000340-22-6 | 1H-Pyrrolo[2,3-b]pyridin-3-amine, 6-methyl-5-nitro-
CAS No: 1000340-22-6 Catalog No: AG0000CY MDL No:
Product Description
Catalog Number:
AG0000CY
Chemical Name:
1H-Pyrrolo[2,3-b]pyridin-3-amine, 6-methyl-5-nitro-
CAS Number:
1000340-22-6
Molecular Formula:
C8H8N4O2
Molecular Weight:
192.1747
IUPAC Name:
6-methyl-5-nitro-1H-pyrrolo[2,3-b]pyridin-3-amine
InChI:
InChI=1S/C8H8N4O2/c1-4-7(12(13)14)2-5-6(9)3-10-8(5)11-4/h2-3H,9H2,1H3,(H,10,11)
InChI Key:
ZTTVWMZUDPJIRK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2c(N)c[nH]c2nc1C
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.065g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.178g/mol
Monoisotopic Mass:
192.065g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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