Home Halogens 3-chloro-6-(1H-pyrazol-4-yl)pyridazine

3-chloro-6-(1H-pyrazol-4-yl)pyridazine

CAS No.:
1211519-08-2
Catalog Number:
AG008TPF
Molecular Formula:
C7H5ClN4
Molecular Weight:
180.5944
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Product Description
Catalog Number:
AG008TPF
Chemical Name:
3-chloro-6-(1H-pyrazol-4-yl)pyridazine
CAS Number:
1211519-08-2
Molecular Formula:
C7H5ClN4
Molecular Weight:
180.5944
MDL Number:
MFCD28053429
IUPAC Name:
3-chloro-6-(1H-pyrazol-4-yl)pyridazine
InChI:
InChI=1S/C7H5ClN4/c8-7-2-1-6(11-12-7)5-3-9-10-4-5/h1-4H,(H,9,10)
InChI Key:
QMWYXCNBZRQEFI-UHFFFAOYSA-N
SMILES:
Clc1ccc(nn1)c1c[nH]nc1
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.02g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.595g/mol
Monoisotopic Mass:
180.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties