Name: Name:1H-Imidazole-5-carboxylic acid, 4-acetyl-2-propyl-, ethyl ester
Brand: Angene
SKU: AG001K08
Rating: 90 (10 reviews)

1H-Imidazole-5-carboxylic acid, 4-acetyl-2-propyl-, ethyl ester

CAS No.:

144690-07-3

Catalog Number:

AG001K08

Molecular Formula:

C11H16N2O3

Molecular Weight:

224.2563

Catalog Number:

AG001K08

Chemical Name:

1H-Imidazole-5-carboxylic acid, 4-acetyl-2-propyl-, ethyl ester

CAS Number:

144690-07-3

Molecular Formula:

C11H16N2O3

Molecular Weight:

224.2563

MDL Number:

MFCD18910535

IUPAC Name:

ethyl 4-acetyl-2-propyl-1H-imidazole-5-carboxylate

InChI:

InChI=1S/C11H16N2O3/c1-4-6-8-12-9(7(3)14)10(13-8)11(15)16-5-2/h4-6H2,1-3H3,(H,12,13)

InChI Key:

VZPSJLSTXDBKLC-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1[nH]c(nc1C(=O)C)CCC

Complexity:

268

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

224.116g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.26g/mol

Monoisotopic Mass:

224.116g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8