AG01A4BW

Name: 5-chloro-2-[(4-chlorophenyl)sulfanyl]benzoic acid
Brand: Angene Chemical
SKU: AG01A4BW

5101-53-1 | 5-chloro-2-[(4-chlorophenyl)sulfanyl]benzoic acid

AG01A4BW

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CAS Number	5101-53-1
Catalog Number	AG01A4BW
Chemical Name	5-chloro-2-[(4-chlorophenyl)sulfanyl]benzoic acid
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
MDL Number	MFCD18977116
Molecular Formula	C13H8Cl2O2S
Molecular Weight	299.1724
SMILES	OC(C1=C(SC2=CC=C(Cl)C=C2)C=CC(Cl)=C1)=O
Synonyms	5-chloro-2-[(4-chlorophenyl)sulfanyl]benzoic acid, 5101-53-1, ZINC90225704, AKOS012822927, MCULE-6808051094, NE27843, 5-chloro-2-(4-chlorophenylthio)benzoic acid, Z1592025353,

Complexity	293
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	297.962g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	299.165g/mol
Monoisotopic Mass	297.962g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.9

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited