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Home > Pyridines > 1803591-96-9
1803591-96-9 | 2-{1H-pyrrolo[2,3-c]pyridin-3-yl}acetonitrile
CAS No: 1803591-96-9 Catalog No: AG01BDAC MDL No:MFCD28551375
Product Description
Catalog Number:
AG01BDAC
Chemical Name:
2-{1H-pyrrolo[2,3-c]pyridin-3-yl}acetonitrile
CAS Number:
1803591-96-9
Molecular Formula:
C9H7N3
Molecular Weight:
157.1720
MDL Number:
MFCD28551375
IUPAC Name:
2-(1H-pyrrolo[2,3-c]pyridin-3-yl)acetonitrile
InChI:
InChI=1S/C9H7N3/c10-3-1-7-5-12-9-6-11-4-2-8(7)9/h2,4-6,12H,1H2
InChI Key:
YKGCSYVFOMBTPZ-UHFFFAOYSA-N
SMILES:
N#CCc1c[nH]c2c1ccnc2
Properties
Complexity:
205
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:
1
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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