AG00GUGS

Name: 3-[(phenylsulfanyl)methyl]furan-2-carboxylic acid
Brand: Angene Chemical
SKU: AG00GUGS

878465-81-7 | 3-[(phenylsulfanyl)methyl]furan-2-carboxylic acid

AG00GUGS

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CAS Number	878465-81-7
Catalog Number	AG00GUGS
Chemical Name	3-[(phenylsulfanyl)methyl]furan-2-carboxylic acid
IUPAC Name	3-(phenylsulfanylmethyl)furan-2-carboxylic acid
InChI	InChI=1S/C12H10O3S/c13-12(14)11-9(6-7-15-11)8-16-10-4-2-1-3-5-10/h1-7H,8H2,(H,13,14)
InChI Key	YCGOMTXSMKAZBN-UHFFFAOYSA-N
MDL Number	MFCD08245265
Molecular Formula	C12H10O3S
Molecular Weight	234.2710
SMILES	O=C(C1=C(CSC2=CC=CC=C2)C=CO1)O
Synonyms	3-[(phenylthio)methyl]-2-furoic acid, 878465-81-7, 3-[(phenylsulfanyl)methyl]furan-2-carboxylic acid, 3-((Phenylthio)methyl)furan-2-carboxylic acid, AC1Q72AH, MLS001174105, CHEMBL1446302, CTK7J1311, HMS2900F21, ZINC8231194, AKOS009088117, MCULE-7389872122, NE24675, SMR000594755, EN300-24302, J-510386, Z188924056, 2-fluoro-4-(hydroxymethyl)benzonitrile, CID9361740, 3-(phenylsulfanylmethyl)furan-2-carboxylic Acid, 3-methyl-6-[2-(trifluoromethyl)phenyl]isoxazolo[5,4-b]pyridine-4-carboxylic acid, 872319-69-2,

Complexity	238
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	234.035g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	234.269g/mol
Monoisotopic Mass	234.035g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	75.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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