Name: Name:5-chloro-2-[(4-chlorophenyl)sulfanyl]benzoic acid
Brand: Angene
SKU: AG01A4BW
Rating: 90 (10 reviews)

5-chloro-2-[(4-chlorophenyl)sulfanyl]benzoic acid

CAS No.:

5101-53-1

Catalog Number:

AG01A4BW

Molecular Formula:

C13H8Cl2O2S

Molecular Weight:

299.1724

Catalog Number:

AG01A4BW

Chemical Name:

5-chloro-2-[(4-chlorophenyl)sulfanyl]benzoic acid

CAS Number:

5101-53-1

Molecular Formula:

C13H8Cl2O2S

Molecular Weight:

299.1724

MDL Number:

MFCD18977116

IUPAC Name:

5-chloro-2-(4-chlorophenyl)sulfanylbenzoic acid

InChI:

InChI=1S/C13H8Cl2O2S/c14-8-1-4-10(5-2-8)18-12-6-3-9(15)7-11(12)13(16)17/h1-7H,(H,16,17)

InChI Key:

YVCUWBJKGWDSBE-UHFFFAOYSA-N

SMILES:

Clc1ccc(cc1)Sc1ccc(cc1C(=O)O)Cl

Complexity:

293

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

297.962g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

299.165g/mol

Monoisotopic Mass:

297.962g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.9