AG019Y3Q

Name: 3-([(2-Fluorophenyl)sulfanyl]methyl)-1-benzofuran-2-carboxylic acid
Brand: Angene Chemical
SKU: AG019Y3Q

1040042-28-1 | 3-([(2-Fluorophenyl)sulfanyl]methyl)-1-benzofuran-2-carboxylic acid

AG019Y3Q

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CAS Number	1040042-28-1
Catalog Number	AG019Y3Q
Chemical Name	3-([(2-Fluorophenyl)sulfanyl]methyl)-1-benzofuran-2-carboxylic acid
IUPAC Name	3-[(2-fluorophenyl)sulfanylmethyl]-1-benzofuran-2-carboxylic acid
InChI	InChI=1S/C16H11FO3S/c17-12-6-2-4-8-14(12)21-9-11-10-5-1-3-7-13(10)20-15(11)16(18)19/h1-8H,9H2,(H,18,19)
InChI Key	AKHCCAYLTYUWNU-UHFFFAOYSA-N
MDL Number	MFCD13378779
Molecular Formula	C16H11FO3S
Molecular Weight	302.3201
SMILES	OC(C1=C(CSC2=C(F)C=CC=C2)C2=C(C=CC=C2)O1)=O
Synonyms	3-{[(2-fluorophenyl)sulfanyl]methyl}-1-benzofuran-2-carboxylic acid, 1040042-28-1, AC1Q72AE, CTK7J1253, ZINC20368752, AKOS008104986, MCULE-5570365451, NE24689, EN300-56918,

Complexity	379
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	302.041g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	302.319g/mol
Monoisotopic Mass	302.041g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	75.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.3

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