Name: Name:4-[2-(methylsulfanyl)-1H-imidazol-1-yl]benzoic acid
Brand: Angene
SKU: AG019UZ0
Rating: 90 (10 reviews)

4-[2-(methylsulfanyl)-1H-imidazol-1-yl]benzoic acid

CAS No.:

1146290-23-4

Catalog Number:

AG019UZ0

Molecular Formula:

C11H10N2O2S

Molecular Weight:

234.2743

Catalog Number:

AG019UZ0

Chemical Name:

4-[2-(methylsulfanyl)-1H-imidazol-1-yl]benzoic acid

CAS Number:

1146290-23-4

Molecular Formula:

C11H10N2O2S

Molecular Weight:

234.2743

MDL Number:

MFCD11858040

IUPAC Name:

4-(2-methylsulfanylimidazol-1-yl)benzoic acid

InChI:

InChI=1S/C11H10N2O2S/c1-16-11-12-6-7-13(11)9-4-2-8(3-5-9)10(14)15/h2-7H,1H3,(H,14,15)

InChI Key:

ZCICHLBTRTUUKQ-UHFFFAOYSA-N

SMILES:

CSc1nccn1c1ccc(cc1)C(=O)O

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

234.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

234.273g/mol

Monoisotopic Mass:

234.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: