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61070-98-2 | 3,4-PYRIDAZINEDIAMINE
CAS No: 61070-98-2 Catalog No: AG00372T MDL No:MFCD01646101
Product Description
Catalog Number:
AG00372T
Chemical Name:
3,4-PYRIDAZINEDIAMINE
CAS Number:
61070-98-2
Molecular Formula:
C4H6N4
Molecular Weight:
110.1172
MDL Number:
MFCD01646101
IUPAC Name:
pyridazine-3,4-diamine
InChI:
InChI=1S/C4H6N4/c5-3-1-2-7-8-4(3)6/h1-2H,(H2,5,7)(H2,6,8)
InChI Key:
BXFLYXZXQZSHOZ-UHFFFAOYSA-N
SMILES:
Nc1nnccc1N
Properties
Complexity:
74.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.059g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
110.12g/mol
Monoisotopic Mass:
110.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
Literature
| Title | Journal |
|---|---|
| Duplex molecular strands based on the 3,6-diaminopyridazine hydrogen bonding motif: amplifying small-molecule self-assembly preferences through preorganization and iterative arrangement of binding residues. | Journal of the American Chemical Society 20050216 |
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