Name: Name:1H-Pyrrole-2,4-dicarboxylic acid, 5-amino-, 2,4-diethyl ester
Brand: Angene
SKU: AG002GGM
Rating: 90 (10 reviews)

1H-Pyrrole-2,4-dicarboxylic acid, 5-amino-, 2,4-diethyl ester

CAS No.:

187724-98-7

Catalog Number:

AG002GGM

Molecular Formula:

C10H14N2O4

Molecular Weight:

226.2292

Catalog Number:

AG002GGM

Chemical Name:

1H-Pyrrole-2,4-dicarboxylic acid, 5-amino-, 2,4-diethyl ester

CAS Number:

187724-98-7

Molecular Formula:

C10H14N2O4

Molecular Weight:

226.2292

MDL Number:

MFCD09837638

IUPAC Name:

diethyl 5-amino-1H-pyrrole-2,4-dicarboxylate

InChI:

InChI=1S/C10H14N2O4/c1-3-15-9(13)6-5-7(12-8(6)11)10(14)16-4-2/h5,12H,3-4,11H2,1-2H3

InChI Key:

YEWDOWIBJZTOCM-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cc(c([nH]1)N)C(=O)OCC

Complexity:

270

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

226.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

226.232g/mol

Monoisotopic Mass:

226.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7