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75776-47-5 | 4,6-Diaminonicotinonitrile
CAS No: 75776-47-5 Catalog No: AG005IEO MDL No:MFCD07780773
Product Description
Catalog Number:
AG005IEO
Chemical Name:
4,6-Diaminonicotinonitrile
CAS Number:
75776-47-5
Molecular Formula:
C6H6N4
Molecular Weight:
134.1386
MDL Number:
MFCD07780773
IUPAC Name:
4,6-diaminopyridine-3-carbonitrile
InChI:
InChI=1S/C6H6N4/c7-2-4-3-10-6(9)1-5(4)8/h1,3H,(H4,8,9,10)
InChI Key:
TWMYIGNIDPMOSD-UHFFFAOYSA-N
SMILES:
Nc1cc(N)ncc1C#N
NSC Number:
165522
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
134.142g/mol
Monoisotopic Mass:
134.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
88.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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