Home Halogens Pyrimidine, 4-chloro-6-methoxy-2-methyl-5-nitro-

Pyrimidine, 4-chloro-6-methoxy-2-methyl-5-nitro-

CAS No.:
60331-15-9
Catalog Number:
AG00IAOV
Molecular Formula:
C6H6ClN3O3
Molecular Weight:
203.5831
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Product Description
Catalog Number:
AG00IAOV
Chemical Name:
Pyrimidine, 4-chloro-6-methoxy-2-methyl-5-nitro-
CAS Number:
60331-15-9
Molecular Formula:
C6H6ClN3O3
Molecular Weight:
203.5831
MDL Number:
MFCD29922356
IUPAC Name:
4-chloro-6-methoxy-2-methyl-5-nitropyrimidine
InChI:
InChI=1S/C6H6ClN3O3/c1-3-8-5(7)4(10(11)12)6(9-3)13-2/h1-2H3
InChI Key:
XENBELIGWDKZOP-UHFFFAOYSA-N
SMILES:
COc1nc(C)nc(c1[N+](=O)[O-])Cl
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.01g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.582g/mol
Monoisotopic Mass:
203.01g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties