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Home > Pyridines > 874216-46-3
874216-46-3 | Pentanenitrile, 3-imino-4-methyl-2-(3-pyridinylhydrazono)-, (2Z)-
CAS No: 874216-46-3 Catalog No: AG004J9S MDL No:
Product Description
Catalog Number:
AG004J9S
Chemical Name:
Pentanenitrile, 3-imino-4-methyl-2-(3-pyridinylhydrazono)-, (2Z)-
CAS Number:
874216-46-3
Molecular Formula:
C11H13N5
Molecular Weight:
215.2544
IUPAC Name:
2-imino-3-methyl-N-(pyridin-3-ylamino)butanimidoyl cyanide
InChI:
InChI=1S/C11H13N5/c1-8(2)11(13)10(6-12)16-15-9-4-3-5-14-7-9/h3-5,7-8,13,15H,1-2H3
InChI Key:
QOJASMSTVSLNAC-UHFFFAOYSA-N
SMILES:
N#C/C(=N\Nc1cccnc1)/C(=N)C(C)C
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.117g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.26g/mol
Monoisotopic Mass:
215.117g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.5
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