AG00EL8V

Name: 2-((2-Hydroxyethyl)thio)benzoic acid
Brand: Angene Chemical
SKU: AG00EL8V

58980-52-2 | 2-((2-Hydroxyethyl)thio)benzoic acid

AG00EL8V

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CAS Number	58980-52-2
Catalog Number	AG00EL8V(AGN-PC-0JPAR2)
Chemical Name	2-((2-Hydroxyethyl)thio)benzoic acid
IUPAC Name	2-(2-hydroxyethylsulfanyl)benzoic acid
InChI	InChI=1S/C9H10O3S/c10-5-6-13-8-4-2-1-3-7(8)9(11)12/h1-4,10H,5-6H2,(H,11,12)
InChI Key	JCSPGCUGRGURES-UHFFFAOYSA-N
MDL Number	MFCD00020273
Molecular Formula	C9H10O3S
Molecular Weight	198.2389
NSC Number	151194
SMILES	C1(C=CC=CC=1SCCO)C(O)=O
Synonyms	2-[(2-hydroxyethyl)sulfanyl]benzoic acid, 58980-52-2, 2-[(2-HYDROXYETHYL)THIO]BENZOIC ACID, 2-((2-Hydroxyethyl)thio)benzoic acid, 2-(2-hydroxy-ethylsulfanyl)-benzoic acid, NSC151194, AC1Q5UAT, AC1L6BN3, Oprea1_352327, SCHEMBL9658167, CTK5A9180, DTXSID60302476, ZINC1761831, MFCD00020273, AKOS000245615, 2-(2-hydroxyethylsulfanyl)benzoic acid, MCULE-5541181003, NSC-151194, Benzoic acid, 2-[(2-hydroxyethyl)thio]-, EN300-78802, W-6242, 2-[(2-hydroxyethyl)thio]benzoic acid, AldrichCPR, Z118461552, AR-1D5615, CID289416, 59467-77-5,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	198.035g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	198.236g/mol
Monoisotopic Mass	198.035g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	82.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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