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686279-09-4 | Ethyl 4,6-dichloro-2-methylnicotinate
CAS No: 686279-09-4 Catalog No: AG0033VE MDL No:MFCD05666193
Product Description
Catalog Number:
AG0033VE
Chemical Name:
Ethyl 4,6-dichloro-2-methylnicotinate
CAS Number:
686279-09-4
Molecular Formula:
C9H9Cl2NO2
Molecular Weight:
234.0793
MDL Number:
MFCD05666193
IUPAC Name:
ethyl 4,6-dichloro-2-methylpyridine-3-carboxylate
InChI:
InChI=1S/C9H9Cl2NO2/c1-3-14-9(13)8-5(2)12-7(11)4-6(8)10/h4H,3H2,1-2H3
InChI Key:
LNIMLSAAPISOEC-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(Cl)cc(nc1C)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:
3.1
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