Name: Name:3-(5-(METHOXYCARBONYL)-1H-PYRROL-2-YL)PROPANOIC ACID
Brand: Angene
SKU: AG01DTBA
Rating: 90 (10 reviews)

3-(5-(METHOXYCARBONYL)-1H-PYRROL-2-YL)PROPANOIC ACID

CAS No.:

1041430-19-6

Catalog Number:

AG01DTBA

Molecular Formula:

C9H11NO4

Molecular Weight:

197.1879

Catalog Number:

AG01DTBA

Chemical Name:

3-(5-(METHOXYCARBONYL)-1H-PYRROL-2-YL)PROPANOIC ACID

CAS Number:

1041430-19-6

Molecular Formula:

C9H11NO4

Molecular Weight:

197.1879

MDL Number:

MFCD20660037

IUPAC Name:

3-(5-methoxycarbonyl-1H-pyrrol-2-yl)propanoic acid

InChI:

InChI=1S/C9H11NO4/c1-14-9(13)7-4-2-6(10-7)3-5-8(11)12/h2,4,10H,3,5H2,1H3,(H,11,12)

InChI Key:

MKIXIQIJLIBXKS-UHFFFAOYSA-N

SMILES:

COC(=O)c1ccc([nH]1)CCC(=O)O

Complexity:

229

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

197.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

197.19g/mol

Monoisotopic Mass:

197.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

79.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7