AG01A3X3

Name: 4-[(4-Chlorophenyl)sulfanyl]benzoic acid
Brand: Angene Chemical
SKU: AG01A3X3

78259-01-5 | 4-[(4-Chlorophenyl)sulfanyl]benzoic acid

AG01A3X3

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CAS Number	78259-01-5
Catalog Number	AG01A3X3
Chemical Name	4-[(4-Chlorophenyl)sulfanyl]benzoic acid
IUPAC Name	4-(4-chlorophenyl)sulfanylbenzoic acid
InChI	InChI=1S/C13H9ClO2S/c14-10-3-7-12(8-4-10)17-11-5-1-9(2-6-11)13(15)16/h1-8H,(H,15,16)
InChI Key	UWLBXSFDJVORCM-UHFFFAOYSA-N
MDL Number	MFCD00496639
Molecular Formula	C13H9ClO2S
Molecular Weight	264.7274
SMILES	OC(C1=CC=C(SC2=CC=C(Cl)C=C2)C=C1)=O
Synonyms	4-[(4-chlorophenyl)sulfanyl]benzoic acid, 78259-01-5, 4-(4-chlorophenyl)sulfanylbenzoic Acid, AC1NF3X0, SCHEMBL9418097, 4-(4-chlorophenylthio)benzoic acid, ZINC3200334, AKOS003235616, MCULE-5040037213, NE22348, Z1592042255, CID4677535,

Complexity	256
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	264.001g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	264.723g/mol
Monoisotopic Mass	264.001g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.7

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