Name: Name:3-[(3-fluorophenyl)sulfanyl]-2-hydroxy-2-methylpropanoic acid
Brand: Angene
SKU: AG01B9NP
Rating: 90 (10 reviews)

3-[(3-fluorophenyl)sulfanyl]-2-hydroxy-2-methylpropanoic acid

CAS No.:

1506047-42-2

Catalog Number:

AG01B9NP

Molecular Formula:

C10H11FO3S

Molecular Weight:

230.2559

Catalog Number:

AG01B9NP

Chemical Name:

3-[(3-fluorophenyl)sulfanyl]-2-hydroxy-2-methylpropanoic acid

CAS Number:

1506047-42-2

Molecular Formula:

C10H11FO3S

Molecular Weight:

230.2559

MDL Number:

MFCD23825707

IUPAC Name:

3-(3-fluorophenyl)sulfanyl-2-hydroxy-2-methylpropanoic acid

InChI:

InChI=1S/C10H11FO3S/c1-10(14,9(12)13)6-15-8-4-2-3-7(11)5-8/h2-5,14H,6H2,1H3,(H,12,13)

InChI Key:

FXKDJQPJFWKUJT-UHFFFAOYSA-N

SMILES:

Fc1cccc(c1)SCC(C(=O)O)(O)C

Complexity:

237

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.041g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.253g/mol

Monoisotopic Mass:

230.041g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7