AG004UEX

Name: 2-((3-Fluorobenzyl)thio)ethanol
Brand: Angene Chemical
SKU: AG004UEX

85582-62-3 | 2-((3-Fluorobenzyl)thio)ethanol

AG004UEX

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CAS Number	85582-62-3
Catalog Number	AG004UEX(AGN-PC-0NK8N1)
Chemical Name	2-((3-Fluorobenzyl)thio)ethanol
IUPAC Name	2-[(3-fluorophenyl)methylsulfanyl]ethanol
InChI	InChI=1S/C9H11FOS/c10-9-3-1-2-8(6-9)7-12-5-4-11/h1-3,6,11H,4-5,7H2
InChI Key	WPHAPQOGPSLSLL-UHFFFAOYSA-N
MDL Number	MFCD04308181
Molecular Formula	C9H11FOS
Molecular Weight	186.2464
SMILES	C1=C(C=CC=C1F)CSCCO
Synonyms	2-[(3-FLUOROBENZYL)THIO]ETHANOL, 85582-62-3, WPHAPQOGPSLSLL-UHFFFAOYSA-N, 2-((3-Fluorobenzyl)thio)ethanol, SCHEMBL15568406, CTK5F5270, DTXSID30509657, CHEMBRDG-BB 9071407, 2-[(3-Fluorobenzyl)sulfanyl]ethanol, MFCD04308181, ZINC19094305, 2-Hydroxyethyl p-fluorobenzyl sulfide, AKOS009166756, AJ-72402, Y-1286, 2-{[(3-Fluorophenyl)methyl]sulfanyl}ethan-1-ol, CHEMBRDG-BB9071407,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	186.051g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	186.244g/mol
Monoisotopic Mass	186.051g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	45.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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