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141238-23-5 | 2-Pyridinecarboxylic acid, 3-chloro-5-nitro-
CAS No: 141238-23-5 Catalog No: AG001G3V MDL No:MFCD14584667
Product Description
Catalog Number:
AG001G3V
Chemical Name:
2-Pyridinecarboxylic acid, 3-chloro-5-nitro-
CAS Number:
141238-23-5
Molecular Formula:
C6H3ClN2O4
Molecular Weight:
202.5520
MDL Number:
MFCD14584667
IUPAC Name:
3-chloro-5-nitropyridine-2-carboxylic acid
InChI:
InChI=1S/C6H3ClN2O4/c7-4-1-3(9(12)13)2-8-5(4)6(10)11/h1-2H,(H,10,11)
InChI Key:
BNPDDLSKUUEFAA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc(c(c1)Cl)C(=O)O
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.978g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.55g/mol
Monoisotopic Mass:
201.978g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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