AG01AHH8

Name: 2-(Phenylsulfanyl)butanoic acid
Brand: Angene Chemical
SKU: AG01AHH8

62675-40-5 | 2-(Phenylsulfanyl)butanoic acid

AG01AHH8

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CAS Number	62675-40-5
Catalog Number	AG01AHH8(AGN-PC-0MY1T5)
Chemical Name	2-(Phenylsulfanyl)butanoic acid
IUPAC Name	2-phenylsulfanylbutanoic acid
InChI	InChI=1S/C10H12O2S/c1-2-9(10(11)12)13-8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,11,12)
InChI Key	GTMBPAXUQQLAGD-UHFFFAOYSA-N
MDL Number	MFCD08696267
Molecular Formula	C10H12O2S
Molecular Weight	196.2661
SMILES	CCC(C(O)=O)SC1=CC=CC=C1
Synonyms	2-(phenylsulfanyl)butanoic acid, 62675-40-5, 2-(phenylthio)butanoic acid, Butanoic acid, 2-(phenylthio)-, SCHEMBL1931269, CTK2B4626, DTXSID70438891, AKOS000102228, AKOS017282970, MCULE-7895469378, NE29590, TL8006850, EN300-74739, Z149157470, Ethyl(phenylthio)acetate, 2-phenylsulfanylbutanoic Acid, CID10375436, 7605-25-6,

Complexity	164
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.056g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	196.264g/mol
Monoisotopic Mass	196.056g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	62.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	3

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