Name: Name:2-Thiophenecarboxylicacid, 3-phenyl-
Brand: Angene
SKU: AG007GPC
Rating: 90 (10 reviews)

2-Thiophenecarboxylicacid, 3-phenyl-

CAS No.:

10341-88-5

Catalog Number:

AG007GPC

Molecular Formula:

C11H8O2S

Molecular Weight:

204.2450

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Product Description

Catalog Number:

AG007GPC

Chemical Name:

2-Thiophenecarboxylicacid, 3-phenyl-

CAS Number:

10341-88-5

Molecular Formula:

C11H8O2S

Molecular Weight:

204.2450

MDL Number:

MFCD06358640

IUPAC Name:

3-phenylthiophene-2-carboxylic acid

InChI:

InChI=1S/C11H8O2S/c12-11(13)10-9(6-7-14-10)8-4-2-1-3-5-8/h1-7H,(H,12,13)

InChI Key:

KWWGBNRBZMJKPA-UHFFFAOYSA-N

SMILES:

OC(=O)c1sccc1c1ccccc1

Properties

Complexity:

211

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

204.025g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

204.243g/mol

Monoisotopic Mass:

204.025g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101

Properties