Name: Name:2-(carbamoylmethyl)-4-methyl-1H-pyrrole-3-carboxylic acid
Brand: Angene
SKU: AG01C21V
Rating: 90 (10 reviews)

2-(carbamoylmethyl)-4-methyl-1H-pyrrole-3-carboxylic acid

CAS No.:

1909337-20-7

Catalog Number:

AG01C21V

Molecular Formula:

C8H10N2O3

Molecular Weight:

182.1766

Catalog Number:

AG01C21V

Chemical Name:

2-(carbamoylmethyl)-4-methyl-1H-pyrrole-3-carboxylic acid

CAS Number:

1909337-20-7

Molecular Formula:

C8H10N2O3

Molecular Weight:

182.1766

MDL Number:

MFCD29047539

IUPAC Name:

2-(2-amino-2-oxoethyl)-4-methyl-1H-pyrrole-3-carboxylic acid

InChI:

InChI=1S/C8H10N2O3/c1-4-3-10-5(2-6(9)11)7(4)8(12)13/h3,10H,2H2,1H3,(H2,9,11)(H,12,13)

InChI Key:

BSMKQANUPBCSAH-UHFFFAOYSA-N

SMILES:

NC(=O)Cc1[nH]cc(c1C(=O)O)C

Complexity:

229

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

182.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

182.179g/mol

Monoisotopic Mass:

182.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

96.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.6