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84853-99-6 | 4-Pyridinecarbonylchloride, 1,2-dihydro-1-methyl-2-oxo-
CAS No: 84853-99-6 Catalog No: AG004WOK MDL No:
Product Description
Catalog Number:
AG004WOK
Chemical Name:
4-Pyridinecarbonylchloride, 1,2-dihydro-1-methyl-2-oxo-
CAS Number:
84853-99-6
Molecular Formula:
C7H6ClNO2
Molecular Weight:
171.5810
IUPAC Name:
1-methyl-2-oxopyridine-4-carbonyl chloride
InChI:
InChI=1S/C7H6ClNO2/c1-9-3-2-5(7(8)11)4-6(9)10/h2-4H,1H3
InChI Key:
UFKLZCYYYFQKPJ-UHFFFAOYSA-N
SMILES:
ClC(=O)c1ccn(c(=O)c1)C
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.58g/mol
Monoisotopic Mass:
171.009g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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