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1677-80-1 | Pyridazine, 3,4-dichloro-
CAS No: 1677-80-1 Catalog No: AG001XJI MDL No:MFCD20040517
Product Description
Catalog Number:
AG001XJI
Chemical Name:
Pyridazine, 3,4-dichloro-
CAS Number:
1677-80-1
Molecular Formula:
C4H2Cl2N2
Molecular Weight:
148.9781
MDL Number:
MFCD20040517
IUPAC Name:
3,4-dichloropyridazine
InChI:
InChI=1S/C4H2Cl2N2/c5-3-1-2-7-8-4(3)6/h1-2H
InChI Key:
JADVVTZXHQUFLS-UHFFFAOYSA-N
SMILES:
Clc1nnccc1Cl
NSC Number:
73470
Properties
Complexity:
78.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.96g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.974g/mol
Monoisotopic Mass:
147.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Literature
| Title | Journal |
|---|---|
| 6-Chloro-3-(3-methyl-phen-yl)-1,2,4-triazolo[4,3-b]pyridazine. | Acta crystallographica. Section E, Structure reports online 20111001 |
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