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192566-87-3 | 4-Pyridinecarboxylic acid, 2,6-dichloro-, 2,2-dimethoxypropyl ester
CAS No: 192566-87-3 Catalog No: AG002G3F MDL No:
Product Description
Catalog Number:
AG002G3F
Chemical Name:
4-Pyridinecarboxylic acid, 2,6-dichloro-, 2,2-dimethoxypropyl ester
CAS Number:
192566-87-3
Molecular Formula:
C11H13Cl2NO4
Molecular Weight:
294.1312
IUPAC Name:
2,2-dimethoxypropyl 2,6-dichloropyridine-4-carboxylate
InChI:
InChI=1S/C11H13Cl2NO4/c1-11(16-2,17-3)6-18-10(15)7-4-8(12)14-9(13)5-7/h4-5H,6H2,1-3H3
InChI Key:
GNJMQXQJGXSYLH-UHFFFAOYSA-N
SMILES:
COC(COC(=O)c1cc(Cl)nc(c1)Cl)(OC)C
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.022g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.128g/mol
Monoisotopic Mass:
293.022g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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