Home Halogens Methyl 2,6-dichloro-5-nitropyrimidine-4-carboxylate

Methyl 2,6-dichloro-5-nitropyrimidine-4-carboxylate

CAS No.:
52047-13-9
Catalog Number:
AG00DL8O
Molecular Formula:
C6H3Cl2N3O4
Molecular Weight:
252.0117
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$260
- +
1g
95%
1 week
United States
$592
- +
Product Description
Catalog Number:
AG00DL8O
Chemical Name:
Methyl 2,6-dichloro-5-nitropyrimidine-4-carboxylate
CAS Number:
52047-13-9
Molecular Formula:
C6H3Cl2N3O4
Molecular Weight:
252.0117
MDL Number:
MFCD09475418
IUPAC Name:
methyl 2,6-dichloro-5-nitropyrimidine-4-carboxylate
InChI:
InChI=1S/C6H3Cl2N3O4/c1-15-5(12)2-3(11(13)14)4(7)10-6(8)9-2/h1H3
InChI Key:
QOZVZJLPNJOHFA-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc(Cl)nc(c1[N+](=O)[O-])Cl
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.95g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.007g/mol
Monoisotopic Mass:
250.95g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
97.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties