Name: Name:1H-Pyrrole-3-carboxylic acid, 4-(2-chloroacetyl)-2,5-dimethyl-, ethyl ester
Brand: Angene
SKU: AG000N6S
Rating: 90 (10 reviews)

1H-Pyrrole-3-carboxylic acid, 4-(2-chloroacetyl)-2,5-dimethyl-, ethyl ester

CAS No.:

125102-42-3

Catalog Number:

AG000N6S

Molecular Formula:

C11H14ClNO3

Molecular Weight:

243.6868

Catalog Number:

AG000N6S

Chemical Name:

1H-Pyrrole-3-carboxylic acid, 4-(2-chloroacetyl)-2,5-dimethyl-, ethyl ester

CAS Number:

125102-42-3

Molecular Formula:

C11H14ClNO3

Molecular Weight:

243.6868

MDL Number:

MFCD03950735

IUPAC Name:

ethyl 4-(2-chloroacetyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate

InChI:

InChI=1S/C11H14ClNO3/c1-4-16-11(15)10-7(3)13-6(2)9(10)8(14)5-12/h13H,4-5H2,1-3H3

InChI Key:

ZRAOZMOUBXPYMW-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1c(C)[nH]c(c1C(=O)CCl)C

Complexity:

282

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.066g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.687g/mol

Monoisotopic Mass:

243.066g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

59.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: