Home Other Building Blocks 2-CHLORO-3-(3,5-DIMETHYL-PYRAZOL-1-YL)-QUINOXALINE

2-CHLORO-3-(3,5-DIMETHYL-PYRAZOL-1-YL)-QUINOXALINE

CAS No.:
245039-37-6
Catalog Number:
AG00BDMF
Molecular Formula:
C13H11ClN4
Molecular Weight:
258.7062
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Product Description
Catalog Number:
AG00BDMF
Chemical Name:
2-CHLORO-3-(3,5-DIMETHYL-PYRAZOL-1-YL)-QUINOXALINE
CAS Number:
245039-37-6
Molecular Formula:
C13H11ClN4
Molecular Weight:
258.7062
MDL Number:
MFCD00140719
IUPAC Name:
2-chloro-3-(3,5-dimethylpyrazol-1-yl)quinoxaline
InChI:
InChI=1S/C13H11ClN4/c1-8-7-9(2)18(17-8)13-12(14)15-10-5-3-4-6-11(10)16-13/h3-7H,1-2H3
InChI Key:
WZFNHSWASDLENP-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1)C)c1nc2ccccc2nc1Cl
Properties
Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.067g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.709g/mol
Monoisotopic Mass:
258.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties