Home Nitros 2-Chloro-4-methoxy-5-nitropyrimidine

2-Chloro-4-methoxy-5-nitropyrimidine

CAS No.:
282102-07-2
Catalog Number:
AG00BG4M
Molecular Formula:
C5H4ClN3O3
Molecular Weight:
189.5566
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Product Description
Catalog Number:
AG00BG4M
Chemical Name:
2-Chloro-4-methoxy-5-nitropyrimidine
CAS Number:
282102-07-2
Molecular Formula:
C5H4ClN3O3
Molecular Weight:
189.5566
MDL Number:
MFCD00955634
IUPAC Name:
2-chloro-4-methoxy-5-nitropyrimidine
InChI:
InChI=1S/C5H4ClN3O3/c1-12-4-3(9(10)11)2-7-5(6)8-4/h2H,1H3
InChI Key:
JMFJZBKFBHAICF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc(nc1OC)Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.994g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.555g/mol
Monoisotopic Mass:
188.994g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties