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1392466-95-3 | 2-Pyridinecarboxylic acid, 6-methyl-5-(1-methylethoxy)-, methyl ester
CAS No: 1392466-95-3 Catalog No: AG001AJQ MDL No:
Product Description
Catalog Number:
AG001AJQ
Chemical Name:
2-Pyridinecarboxylic acid, 6-methyl-5-(1-methylethoxy)-, methyl ester
CAS Number:
1392466-95-3
Molecular Formula:
C11H15NO3
Molecular Weight:
209.2417
IUPAC Name:
methyl 6-methyl-5-propan-2-yloxypyridine-2-carboxylate
InChI:
InChI=1S/C11H15NO3/c1-7(2)15-10-6-5-9(11(13)14-4)12-8(10)3/h5-7H,1-4H3
InChI Key:
CTPSZAAJLJVDKC-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(n1)C)OC(C)C
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.245g/mol
Monoisotopic Mass:
209.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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