Name: Name:3-methyl-4-(thiophene-2-amido)benzoic acid
Brand: Angene
SKU: AG01A2Z0
Rating: 90 (10 reviews)

3-methyl-4-(thiophene-2-amido)benzoic acid

CAS No.:

827002-04-0

Catalog Number:

AG01A2Z0

Molecular Formula:

C13H11NO3S

Molecular Weight:

261.2963

Catalog Number:

AG01A2Z0

Chemical Name:

3-methyl-4-(thiophene-2-amido)benzoic acid

CAS Number:

827002-04-0

Molecular Formula:

C13H11NO3S

Molecular Weight:

261.2963

MDL Number:

MFCD06623944

IUPAC Name:

3-methyl-4-(thiophene-2-carbonylamino)benzoic acid

InChI:

InChI=1S/C13H11NO3S/c1-8-7-9(13(16)17)4-5-10(8)14-12(15)11-3-2-6-18-11/h2-7H,1H3,(H,14,15)(H,16,17)

InChI Key:

GDKNIJWRYXSJJJ-UHFFFAOYSA-N

SMILES:

Cc1cc(ccc1NC(=O)c1cccs1)C(=O)O

Complexity:

334

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

261.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

261.295g/mol

Monoisotopic Mass:

261.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7