1H-Pyrrolo[2,3-b]pyridine-5-carbonitrile, 4-chloro-


Chemical Name: 1H-Pyrrolo[2,3-b]pyridine-5-carbonitrile, 4-chloro-
CAS Number: 920966-02-5
Product Number: AG00GTYC(AGN-PC-04G0H0)
Synonyms:
MDL No:
Molecular Formula: C8H4ClN3
Molecular Weight: 177.5905

Identification/Properties


Computed Properties
Molecular Weight:
177.591g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
177.009g/mol
Monoisotopic Mass:
177.009g/mol
Topological Polar Surface Area:
52.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
222
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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