Name: Name:2-(3,4-dimethylphenyl)-1,3-thiazole-5-carboxylic acid
Brand: Angene
SKU: AG01B22H
Rating: 90 (10 reviews)

2-(3,4-dimethylphenyl)-1,3-thiazole-5-carboxylic acid

CAS No.:

886370-23-6

Catalog Number:

AG01B22H

Molecular Formula:

C12H11NO2S

Molecular Weight:

233.2862

Catalog Number:

AG01B22H

Chemical Name:

2-(3,4-dimethylphenyl)-1,3-thiazole-5-carboxylic acid

CAS Number:

886370-23-6

Molecular Formula:

C12H11NO2S

Molecular Weight:

233.2862

MDL Number:

MFCD07375335

IUPAC Name:

2-(3,4-dimethylphenyl)-1,3-thiazole-5-carboxylic acid

InChI:

InChI=1S/C12H11NO2S/c1-7-3-4-9(5-8(7)2)11-13-6-10(16-11)12(14)15/h3-6H,1-2H3,(H,14,15)

InChI Key:

URPWGVUSUCAMIC-UHFFFAOYSA-N

SMILES:

OC(=O)c1cnc(s1)c1ccc(c(c1)C)C

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.285g/mol

Monoisotopic Mass:

233.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2