Name: Name:1H-Pyrrole-2-carboxylic acid, 1-amino-4-bromo-, methyl ester, hydrochloride (1:1)
Brand: Angene
SKU: AG0021TV
Rating: 90 (10 reviews)

1H-Pyrrole-2-carboxylic acid, 1-amino-4-bromo-, methyl ester, hydrochloride (1:1)

CAS No.:

1802489-57-1

Catalog Number:

AG0021TV

Molecular Formula:

C6H8BrClN2O2

Molecular Weight:

255.4969

Catalog Number:

AG0021TV

Chemical Name:

1H-Pyrrole-2-carboxylic acid, 1-amino-4-bromo-, methyl ester, hydrochloride (1:1)

CAS Number:

1802489-57-1

Molecular Formula:

C6H8BrClN2O2

Molecular Weight:

255.4969

MDL Number:

MFCD27665767

IUPAC Name:

methyl 1-amino-4-bromopyrrole-2-carboxylate;hydrochloride

InChI:

InChI=1S/C6H7BrN2O2.ClH/c1-11-6(10)5-2-4(7)3-9(5)8;/h2-3H,8H2,1H3;1H

InChI Key:

XTFHIVXQAZCNHD-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc(cn1N)Br.Cl

Complexity:

165

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

253.946g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

255.496g/mol

Monoisotopic Mass:

253.946g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: