Home Halogens 3-Pyridinecarboxylic acid, 6-chloro-2,4-dimethyl-, methyl ester

3-Pyridinecarboxylic acid, 6-chloro-2,4-dimethyl-, methyl ester

CAS No.:
1256789-09-9
Catalog Number:
AG000OCB
Molecular Formula:
C9H10ClNO2
Molecular Weight:
199.6342
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Product Description
Catalog Number:
AG000OCB
Chemical Name:
3-Pyridinecarboxylic acid, 6-chloro-2,4-dimethyl-, methyl ester
CAS Number:
1256789-09-9
Molecular Formula:
C9H10ClNO2
Molecular Weight:
199.6342
MDL Number:
MFCD18258696
IUPAC Name:
methyl 6-chloro-2,4-dimethylpyridine-3-carboxylate
InChI:
InChI=1S/C9H10ClNO2/c1-5-4-7(10)11-6(2)8(5)9(12)13-3/h4H,1-3H3
InChI Key:
KEFOCFHFGZFNHO-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(C)cc(nc1C)Cl
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.634g/mol
Monoisotopic Mass:
199.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties