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16344-26-6 | 3-Pyridinecarboxylic acid, 2-[(4-chlorophenyl)amino]-
CAS No: 16344-26-6 Catalog No: AG001U4M MDL No:MFCD03114306
Product Description
Catalog Number:
AG001U4M
Chemical Name:
3-Pyridinecarboxylic acid, 2-[(4-chlorophenyl)amino]-
CAS Number:
16344-26-6
Molecular Formula:
C12H9ClN2O2
Molecular Weight:
248.6651
MDL Number:
MFCD03114306
IUPAC Name:
2-(4-chloroanilino)pyridine-3-carboxylic acid
InChI:
InChI=1S/C12H9ClN2O2/c13-8-3-5-9(6-4-8)15-11-10(12(16)17)2-1-7-14-11/h1-7H,(H,14,15)(H,16,17)
InChI Key:
YEXIXVLEDGNAKM-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)Nc1ncccc1C(=O)O
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.035g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
248.666g/mol
Monoisotopic Mass:
248.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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