AG00HSM0

Name: 4-(tert-Butylsulfanyl)benzoic acid
Brand: Angene Chemical
SKU: AG00HSM0

13205-51-1 | 4-(tert-Butylsulfanyl)benzoic acid

AG00HSM0

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COA

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CAS Number	13205-51-1
Catalog Number	AG00HSM0(AGN-PC-0WRAAH)
Chemical Name	4-(tert-Butylsulfanyl)benzoic acid
IUPAC Name	4-tert-butylsulfanylbenzoic acid
InChI	InChI=1S/C11H14O2S/c1-11(2,3)14-9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13)
InChI Key	LCECZYVHSXADNP-UHFFFAOYSA-N
MDL Number	MFCD16692411
Molecular Formula	C11H14O2S
Molecular Weight	210.2927
SMILES	OC(=O)c1ccc(cc1)SC(C)(C)C
Synonyms	4-(tert-butylthio)benzoic acid, 13205-51-1, 4-(tert-butylsulfanyl)benzoic acid, SCHEMBL735343, LCECZYVHSXADNP-UHFFFAOYSA-N, ZINC50913586, AKOS011512878,

Complexity	200
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	210.071g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	210.291g/mol
Monoisotopic Mass	210.071g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

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