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Home > Pyridines > 898786-11-3
898786-11-3 | 2-METHOXY-5-(3-METHYL-2-THENOYL)PYRIDINE
CAS No: 898786-11-3 Catalog No: AG00GXVW MDL No:
Product Description
Catalog Number:
AG00GXVW
Chemical Name:
2-METHOXY-5-(3-METHYL-2-THENOYL)PYRIDINE
CAS Number:
898786-11-3
Molecular Formula:
C12H11NO2S
Molecular Weight:
233.2862
IUPAC Name:
(6-methoxypyridin-3-yl)-(3-methylthiophen-2-yl)methanone
InChI:
InChI=1S/C12H11NO2S/c1-8-5-6-16-12(8)11(14)9-3-4-10(15-2)13-7-9/h3-7H,1-2H3
InChI Key:
NLHCKFIXIFVLBH-UHFFFAOYSA-N
SMILES:
COc1ccc(cn1)C(=O)c1sccc1C
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.285g/mol
Monoisotopic Mass:
233.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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