Home Halogens Ethyl 6-chloro-5-nitronicotinate

Ethyl 6-chloro-5-nitronicotinate

CAS No.:
171876-22-5
Catalog Number:
AG007WA6
Molecular Formula:
C8H7ClN2O4
Molecular Weight:
230.6052
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$119
- +
5g
97%
1 week
United States
$294
- +
Product Description
Catalog Number:
AG007WA6
Chemical Name:
Ethyl 6-chloro-5-nitronicotinate
CAS Number:
171876-22-5
Molecular Formula:
C8H7ClN2O4
Molecular Weight:
230.6052
MDL Number:
MFCD02317481
IUPAC Name:
ethyl 6-chloro-5-nitropyridine-3-carboxylate
InChI:
InChI=1S/C8H7ClN2O4/c1-2-15-8(12)5-3-6(11(13)14)7(9)10-4-5/h3-4H,2H2,1H3
InChI Key:
RJGYARAKIVLQAQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc(c(c1)[N+](=O)[O-])Cl
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.009g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.604g/mol
Monoisotopic Mass:
230.009g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties