Name: Name:4-METHYL-2-(PHENOXYMETHYL)-1,3-THIAZOLE-5-CARBOXYLIC ACID
Brand: Angene
SKU: AG01EKGM
Rating: 90 (10 reviews)

4-METHYL-2-(PHENOXYMETHYL)-1,3-THIAZOLE-5-CARBOXYLIC ACID

CAS No.:

35535-10-5

Catalog Number:

AG01EKGM

Molecular Formula:

C12H11NO3S

Molecular Weight:

249.2856

Catalog Number:

AG01EKGM

Chemical Name:

4-METHYL-2-(PHENOXYMETHYL)-1,3-THIAZOLE-5-CARBOXYLIC ACID

CAS Number:

35535-10-5

Molecular Formula:

C12H11NO3S

Molecular Weight:

249.2856

MDL Number:

MFCD06858123

IUPAC Name:

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

InChI:

InChI=1S/C12H11NO3S/c1-8-11(12(14)15)17-10(13-8)7-16-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,14,15)

InChI Key:

JPXSHGOKVQXIJD-UHFFFAOYSA-N

SMILES:

OC(=O)c1sc(nc1C)COc1ccccc1

Complexity:

269

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

249.284g/mol

Monoisotopic Mass:

249.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7