AG000QCZ

Name: BENZOIC ACID, 5-FLUORO-2-MERCAPTO-
Brand: Angene Chemical
SKU: AG000QCZ

120121-07-5 | BENZOIC ACID, 5-FLUORO-2-MERCAPTO-

AG000QCZ

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CAS Number	120121-07-5
Catalog Number	AG000QCZ(AGN-PC-0KL2B6)
Chemical Name	BENZOIC ACID, 5-FLUORO-2-MERCAPTO-
IUPAC Name	5-fluoro-2-sulfanylbenzoic acid
InChI	InChI=1S/C7H5FO2S/c8-4-1-2-6(11)5(3-4)7(9)10/h1-3,11H,(H,9,10)
InChI Key	WSOZOINWBSJTER-UHFFFAOYSA-N
MDL Number	MFCD02683508
Molecular Formula	C7H5FO2S
Molecular Weight	172.1768
SMILES	OC(C1=C(S)C=CC(F)=C1)=O
Synonyms	5-Fluoro-2-mercaptobenzoic acid, 120121-07-5, 5-fluoro-2-sulfanylbenzoic acid, 5-Fluoro-2-thiobenzoic acid, Benzoic acid, 5-fluoro-2-mercapto-, AC1MD4DQ, 5-fluorothiosalicylic Acid, ACMC-1CIT8, 5-Fluoro-2-mercaptobenzoicacid, SCHEMBL1424485, CTK8C5826, DTXSID40382615, 5-Fluoro-2-mercapto-benzoic acid, WSOZOINWBSJTER-UHFFFAOYSA-N, ZINC5018343, 5-fluoranyl-2-sulfanyl-benzoic acid, MFCD02683508, SBB088623, AKOS009157961, 5-Fluoro-2-mercaptobenzoic acid, 96%, SC-86844, RT-010309, FT-0692726, K-1419, A804436, J-004263, 5-fluoro-2-sulfanyl-benzoic Acid, CID2783371,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.999g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	172.173g/mol
Monoisotopic Mass	171.999g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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