AG00IA2X

Name: 3-[(benzylsulfanyl)methyl]-1-benzofuran-2-carboxylic acid
Brand: Angene Chemical
SKU: AG00IA2X

565174-28-9 | 3-[(benzylsulfanyl)methyl]-1-benzofuran-2-carboxylic acid

AG00IA2X

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CAS Number	565174-28-9
Catalog Number	AG00IA2X
Chemical Name	3-[(benzylsulfanyl)methyl]-1-benzofuran-2-carboxylic acid
IUPAC Name	3-(benzylsulfanylmethyl)-1-benzofuran-2-carboxylic acid
InChI	InChI=1S/C17H14O3S/c18-17(19)16-14(13-8-4-5-9-15(13)20-16)11-21-10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,18,19)
InChI Key	JWTQNYOHZGHMMU-UHFFFAOYSA-N
MDL Number	MFCD03986073
Molecular Formula	C17H14O3S
Molecular Weight	298.3563
SMILES	OC(C1=C(CSCC2=CC=CC=C2)C2=C(C=CC=C2)O1)=O
Synonyms	3-[(benzylsulfanyl)methyl]-1-benzofuran-2-carboxylic acid, 565174-28-9, 3-Benzylsulfanylmethyl-benzofuran-2-carboxylic acid, AC1Q72AO, MLS000775814, AC1M82D4, CHEMBL1485859, CTK7J1258, HMS2717N15, ZINC3361074, MFCD03986073, AKOS000117119, MCULE-1735044354, NE44527, SMR000369382, EN300-06290, Z56917417, 3-(benzylsulfanylmethyl)-1-benzofuran-2-carboxylic acid, CID2478633, 3-(benzylsulfanylmethyl)benzofuran-2-carboxylic Acid,

Complexity	354
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	298.066g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	298.356g/mol
Monoisotopic Mass	298.066g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	75.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.1

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