Name: Name:2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazole-5-carboxylic acid
Brand: Angene
SKU: AG01A1OW
Rating: 90 (10 reviews)

2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazole-5-carboxylic acid

CAS No.:

1157331-90-2

Catalog Number:

AG01A1OW

Molecular Formula:

C12H9NO3S

Molecular Weight:

247.2698

Catalog Number:

AG01A1OW

Chemical Name:

2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazole-5-carboxylic acid

CAS Number:

1157331-90-2

Molecular Formula:

C12H9NO3S

Molecular Weight:

247.2698

MDL Number:

MFCD12065184

IUPAC Name:

2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazole-5-carboxylic acid

InChI:

InChI=1S/C12H9NO3S/c14-12(15)10-6-13-11(17-10)8-1-2-9-7(5-8)3-4-16-9/h1-2,5-6H,3-4H2,(H,14,15)

InChI Key:

IWNHLYGNTGDUNG-UHFFFAOYSA-N

SMILES:

OC(=O)c1cnc(s1)c1ccc2c(c1)CCO2

Complexity:

312

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

247.03g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

247.268g/mol

Monoisotopic Mass:

247.03g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5