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137225-05-9 | 4-Pyridinecarbonitrile, 2-(phenylamino)-
CAS No: 137225-05-9 Catalog No: AG0012Y9 MDL No:
Product Description
Catalog Number:
AG0012Y9
Chemical Name:
4-Pyridinecarbonitrile, 2-(phenylamino)-
CAS Number:
137225-05-9
Molecular Formula:
C12H9N3
Molecular Weight:
195.2200
IUPAC Name:
2-anilinopyridine-4-carbonitrile
InChI:
InChI=1S/C12H9N3/c13-9-10-6-7-14-12(8-10)15-11-4-2-1-3-5-11/h1-8H,(H,14,15)
InChI Key:
UAIQYMSTGUYXIP-UHFFFAOYSA-N
SMILES:
N#Cc1ccnc(c1)Nc1ccccc1
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.225g/mol
Monoisotopic Mass:
195.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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