Name: Name:3-Pyridinecarboxylic acid, 6-(1H-imidazol-1-yl)-, ethyl ester
Brand: Angene
SKU: AG000DW5
Rating: 90 (10 reviews)

3-Pyridinecarboxylic acid, 6-(1H-imidazol-1-yl)-, ethyl ester

CAS No.:

1171919-01-9

Catalog Number:

AG000DW5

Molecular Formula:

C11H11N3O2

Molecular Weight:

217.2239

Catalog Number:

AG000DW5

Chemical Name:

3-Pyridinecarboxylic acid, 6-(1H-imidazol-1-yl)-, ethyl ester

CAS Number:

1171919-01-9

Molecular Formula:

C11H11N3O2

Molecular Weight:

217.2239

MDL Number:

MFCD12498710

IUPAC Name:

ethyl 6-imidazol-1-ylpyridine-3-carboxylate

InChI:

InChI=1S/C11H11N3O2/c1-2-16-11(15)9-3-4-10(13-7-9)14-6-5-12-8-14/h3-8H,2H2,1H3

InChI Key:

IOIXFIPWOQLKHR-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1ccc(nc1)n1cncc1

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

217.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

217.228g/mol

Monoisotopic Mass:

217.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2