Name: Name:2-Thiophenecarboxylic acid, 3-amino-4-(4-methylphenyl)-, methyl ester
Brand: Angene
SKU: AG001RP1
Rating: 90 (10 reviews)

2-Thiophenecarboxylic acid, 3-amino-4-(4-methylphenyl)-, methyl ester

CAS No.:

160133-75-5

Catalog Number:

AG001RP1

Molecular Formula:

C13H13NO2S

Molecular Weight:

247.3128

Catalog Number:

AG001RP1

Chemical Name:

2-Thiophenecarboxylic acid, 3-amino-4-(4-methylphenyl)-, methyl ester

CAS Number:

160133-75-5

Molecular Formula:

C13H13NO2S

Molecular Weight:

247.3128

MDL Number:

MFCD04116501

IUPAC Name:

methyl 3-amino-4-(4-methylphenyl)thiophene-2-carboxylate

InChI:

InChI=1S/C13H13NO2S/c1-8-3-5-9(6-4-8)10-7-17-12(11(10)14)13(15)16-2/h3-7H,14H2,1-2H3

InChI Key:

UJJDUVOANRRUHL-UHFFFAOYSA-N

SMILES:

COC(=O)c1scc(c1N)c1ccc(cc1)C

Complexity:

277

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.312g/mol

Monoisotopic Mass:

247.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6