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15827-84-6 | 3-Pyridinecarbonitrile, 4-amino-
CAS No: 15827-84-6 Catalog No: AG001Q3I MDL No:MFCD04035595
Product Description
Catalog Number:
AG001Q3I
Chemical Name:
3-Pyridinecarbonitrile, 4-amino-
CAS Number:
15827-84-6
Molecular Formula:
C6H5N3
Molecular Weight:
119.1240
MDL Number:
MFCD04035595
IUPAC Name:
4-aminopyridine-3-carbonitrile
InChI:
InChI=1S/C6H5N3/c7-3-5-4-9-2-1-6(5)8/h1-2,4H,(H2,8,9)
InChI Key:
LCUHGVFLYAQKDO-UHFFFAOYSA-N
SMILES:
N#Cc1cnccc1N
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
119.048g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
119.127g/mol
Monoisotopic Mass:
119.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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