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137520-86-6 | 3-Pyridinecarboxylic acid, 2,6-dichloro-5-methyl-, ethyl ester
CAS No: 137520-86-6 Catalog No: AG0013H4 MDL No:MFCD03699678
Product Description
Catalog Number:
AG0013H4
Chemical Name:
3-Pyridinecarboxylic acid, 2,6-dichloro-5-methyl-, ethyl ester
CAS Number:
137520-86-6
Molecular Formula:
C9H9Cl2NO2
Molecular Weight:
234.0793
MDL Number:
MFCD03699678
IUPAC Name:
ethyl 2,6-dichloro-5-methylpyridine-3-carboxylate
InChI:
InChI=1S/C9H9Cl2NO2/c1-3-14-9(13)6-4-5(2)7(10)12-8(6)11/h4H,3H2,1-2H3
InChI Key:
BMJQJBGNFQXCJC-UHFFFAOYSA-N
SMILES:
Cc1cc(C(=O)OCC)c(nc1Cl)Cl
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.001g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.076g/mol
Monoisotopic Mass:
233.001g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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