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10177-29-4 | 3-Pyridinecarboxylic acid, 4-chloro-
CAS No: 10177-29-4 Catalog No: AG0005G0 MDL No:MFCD00128860
Product Description
Catalog Number:
AG0005G0
Chemical Name:
3-Pyridinecarboxylic acid, 4-chloro-
CAS Number:
10177-29-4
Molecular Formula:
C6H4ClNO2
Molecular Weight:
157.5545
MDL Number:
MFCD00128860
IUPAC Name:
4-chloropyridine-3-carboxylic acid
InChI:
InChI=1S/C6H4ClNO2/c7-5-1-2-8-3-4(5)6(9)10/h1-3H,(H,9,10)
InChI Key:
IMRGVWZLCZERSQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnccc1Cl
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.993g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.553g/mol
Monoisotopic Mass:
156.993g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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