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Home > Pyridines > 1823898-64-1
1823898-64-1 | 1H-Pyrrolo[2,3-b]pyridine-2-carbonitrile, 5-methyl-
CAS No: 1823898-64-1 Catalog No: AG0023RG MDL No:
Product Description
Catalog Number:
AG0023RG
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-2-carbonitrile, 5-methyl-
CAS Number:
1823898-64-1
Molecular Formula:
C9H7N3
Molecular Weight:
157.1720
IUPAC Name:
5-methyl-1H-pyrrolo[2,3-b]pyridine-2-carbonitrile
InChI:
InChI=1S/C9H7N3/c1-6-2-7-3-8(4-10)12-9(7)11-5-6/h2-3,5H,1H3,(H,11,12)
InChI Key:
OMYCJDPCBCFYCO-UHFFFAOYSA-N
SMILES:
N#Cc1cc2c([nH]1)ncc(c2)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.176g/mol
Monoisotopic Mass:
157.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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