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Home Halogens 6-chloro-N-isopentylpyridazine-3-carboxamide

6-chloro-N-isopentylpyridazine-3-carboxamide

CAS No.:
840488-86-0
Catalog Number:
AG01DWPB
Molecular Formula:
C10H14ClN3O
Molecular Weight:
227.6907
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Product Description
Catalog Number:
AG01DWPB
Chemical Name:
6-chloro-N-isopentylpyridazine-3-carboxamide
CAS Number:
840488-86-0
Molecular Formula:
C10H14ClN3O
Molecular Weight:
227.6907
MDL Number:
MFCD12165835
IUPAC Name:
6-chloro-N-(3-methylbutyl)pyridazine-3-carboxamide
InChI:
InChI=1S/C10H14ClN3O/c1-7(2)5-6-12-10(15)8-3-4-9(11)14-13-8/h3-4,7H,5-6H2,1-2H3,(H,12,15)
InChI Key:
KQBDDYSEVSDDMV-UHFFFAOYSA-N
SMILES:
CC(CCNC(=O)c1ccc(nn1)Cl)C
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.083g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
227.692g/mol
Monoisotopic Mass:
227.083g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
54.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties