Name: Name:1H-Pyrrole-2-carboxylic acid, 3-amino-1-(4-bromophenyl)-, ethyl ester, hydrochloride (1:1)
Brand: Angene
SKU: AG000WTF
Rating: 90 (10 reviews)

1H-Pyrrole-2-carboxylic acid, 3-amino-1-(4-bromophenyl)-, ethyl ester, hydrochloride (1:1)

CAS No.:

1272673-95-6

Catalog Number:

AG000WTF

Molecular Formula:

C13H14BrClN2O2

Molecular Weight:

345.6195

Catalog Number:

AG000WTF

Chemical Name:

1H-Pyrrole-2-carboxylic acid, 3-amino-1-(4-bromophenyl)-, ethyl ester, hydrochloride (1:1)

CAS Number:

1272673-95-6

Molecular Formula:

C13H14BrClN2O2

Molecular Weight:

345.6195

MDL Number:

MFCD26407208

IUPAC Name:

ethyl 3-amino-1-(4-bromophenyl)pyrrole-2-carboxylate;hydrochloride

InChI:

InChI=1S/C13H13BrN2O2.ClH/c1-2-18-13(17)12-11(15)7-8-16(12)10-5-3-9(14)4-6-10;/h3-8H,2,15H2,1H3;1H

InChI Key:

FXROXSUQZAKVRP-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1c(N)ccn1c1ccc(cc1)Br.Cl

Complexity:

293

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

343.993g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

345.621g/mol

Monoisotopic Mass:

343.993g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: