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98140-96-6 | Methyl 6-Aminopyridazine-3-carboxylate
CAS No: 98140-96-6 Catalog No: AG003587 MDL No:MFCD17016033
Product Description
Catalog Number:
AG003587
Chemical Name:
Methyl 6-Aminopyridazine-3-carboxylate
CAS Number:
98140-96-6
Molecular Formula:
C6H7N3O2
Molecular Weight:
153.1387
MDL Number:
MFCD17016033
IUPAC Name:
methyl 6-aminopyridazine-3-carboxylate
InChI:
InChI=1S/C6H7N3O2/c1-11-6(10)4-2-3-5(7)9-8-4/h2-3H,1H3,(H2,7,9)
InChI Key:
UVTBEJGKSJOOIF-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(nn1)N
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.054g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
153.141g/mol
Monoisotopic Mass:
153.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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