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119581-52-1 | 4-Pyridazinecarbonitrile, 3-amino-
CAS No: 119581-52-1 Catalog No: AG000IZW MDL No:MFCD18324663
Product Description
Catalog Number:
AG000IZW
Chemical Name:
4-Pyridazinecarbonitrile, 3-amino-
CAS Number:
119581-52-1
Molecular Formula:
C5H4N4
Molecular Weight:
120.1121
MDL Number:
MFCD18324663
IUPAC Name:
3-aminopyridazine-4-carbonitrile
InChI:
InChI=1S/C5H4N4/c6-3-4-1-2-8-9-5(4)7/h1-2H,(H2,7,9)
InChI Key:
CKCPKMCDMNLLQQ-UHFFFAOYSA-N
SMILES:
N#Cc1ccnnc1N
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.044g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
120.115g/mol
Monoisotopic Mass:
120.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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