Home Nitros 3-Chloro-1-methyl-4-nitro-1h-pyrazole

3-Chloro-1-methyl-4-nitro-1h-pyrazole

CAS No.:
299930-70-4
Catalog Number:
AG00BF6V
Molecular Formula:
C4H4ClN3O2
Molecular Weight:
161.5465
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Product Description
Catalog Number:
AG00BF6V
Chemical Name:
3-Chloro-1-methyl-4-nitro-1h-pyrazole
CAS Number:
299930-70-4
Molecular Formula:
C4H4ClN3O2
Molecular Weight:
161.5465
MDL Number:
MFCD00463968
IUPAC Name:
3-chloro-1-methyl-4-nitropyrazole
InChI:
InChI=1S/C4H4ClN3O2/c1-7-2-3(8(9)10)4(5)6-7/h2H,1H3
InChI Key:
UEDIAFCRVLLBSS-UHFFFAOYSA-N
SMILES:
Cn1nc(c(c1)[N+](=O)[O-])Cl
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.999g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.545g/mol
Monoisotopic Mass:
160.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties