Name: Name:2-{[(2,4-dichlorophenyl)methyl]sulfanyl}acetic acid
Brand: Angene
SKU: AG019X96
Rating: 90 (10 reviews)

2-{[(2,4-dichlorophenyl)methyl]sulfanyl}acetic acid

CAS No.:

65051-31-2

Catalog Number:

AG019X96

Molecular Formula:

C9H8Cl2O2S

Molecular Weight:

251.1296

Catalog Number:

AG019X96

Chemical Name:

2-{[(2,4-dichlorophenyl)methyl]sulfanyl}acetic acid

CAS Number:

65051-31-2

Molecular Formula:

C9H8Cl2O2S

Molecular Weight:

251.1296

MDL Number:

MFCD02755447

IUPAC Name:

2-[(2,4-dichlorophenyl)methylsulfanyl]acetic acid

InChI:

InChI=1S/C9H8Cl2O2S/c10-7-2-1-6(8(11)3-7)4-14-5-9(12)13/h1-3H,4-5H2,(H,12,13)

InChI Key:

GWTAKOPAASARET-UHFFFAOYSA-N

SMILES:

OC(=O)CSCc1ccc(cc1Cl)Cl

NSC Number:

190480

Complexity:

201

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.962g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

251.121g/mol

Monoisotopic Mass:

249.962g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5