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

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

CAS No.:
54368-61-5
Catalog Number:
AG00D864
Molecular Formula:
C7H5Cl2N3O4
Molecular Weight:
266.0383
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$288
- +
5g
95%
1 week
United States
$844
- +
Product Description
Catalog Number:
AG00D864
Chemical Name:
Ethyl 2,6-dichloro-5-nitropyrimidine-4-carboxylate
CAS Number:
54368-61-5
Molecular Formula:
C7H5Cl2N3O4
Molecular Weight:
266.0383
MDL Number:
MFCD00831638
IUPAC Name:
ethyl 2,6-dichloro-5-nitropyrimidine-4-carboxylate
InChI:
InChI=1S/C7H5Cl2N3O4/c1-2-16-6(13)3-4(12(14)15)5(8)11-7(9)10-3/h2H2,1H3
InChI Key:
CXMOEGSGXAUCNZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc(Cl)nc(c1[N+](=O)[O-])Cl
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.966g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.034g/mol
Monoisotopic Mass:
264.966g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
97.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties