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1312772-66-9 | 2-Pyridinecarboxylic acid, 5-(aminocarbonyl)-6-chloro-
CAS No: 1312772-66-9 Catalog No: AG000VTZ MDL No:MFCD24499931
Product Description
Catalog Number:
AG000VTZ
Chemical Name:
2-Pyridinecarboxylic acid, 5-(aminocarbonyl)-6-chloro-
CAS Number:
1312772-66-9
Molecular Formula:
C7H5ClN2O3
Molecular Weight:
200.5792
MDL Number:
MFCD24499931
IUPAC Name:
5-carbamoyl-6-chloropyridine-2-carboxylic acid
InChI:
InChI=1S/C7H5ClN2O3/c8-5-3(6(9)11)1-2-4(10-5)7(12)13/h1-2H,(H2,9,11)(H,12,13)
InChI Key:
IJUYFFSRNZOALH-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(n1)Cl)C(=O)N
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.999g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.578g/mol
Monoisotopic Mass:
199.999g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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