3-Pyridinecarboxylic acid, 4-amino-6-chloro-5-nitro-, ethyl ester


Chemical Name: 3-Pyridinecarboxylic acid, 4-amino-6-chloro-5-nitro-, ethyl ester
CAS Number: 690635-35-9
Product Number: AG00FGNJ(AGN-PC-0OGP0Y)
Synonyms:
MDL No:
Molecular Formula: C8H8ClN3O4
Molecular Weight: 245.6198

Identification/Properties


Computed Properties
Molecular Weight:
245.619g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
245.02g/mol
Monoisotopic Mass:
245.02g/mol
Topological Polar Surface Area:
111A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
283
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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