2-Fluorothiophenol - CAS 2557-78-0

Catalog:	BB018961
Product Name:	2-Fluorothiophenol
CAS:	2557-78-0
Synonyms:	2-fluorobenzenethiol

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	2-fluorobenzenethiol
Description:	2-Fluorothiophenol (CAS# 2557-78-0) is a useful synthetic intermediate especially in the pharmaceutical field.
Molecular Weight:	128.17
Molecular Formula:	C6H5FS
Canonical SMILES:	C1=CC=C(C(=C1)F)S
InChI:	InChI=1S/C6H5FS/c7-5-3-1-2-4-6(5)8/h1-4,8H
InChI Key:	WJTZZPVVTSDNJJ-UHFFFAOYSA-N
Boiling Point:	61-62 °C (35 mmHg)
Purity:	95 %
Density:	1.203 g/cm³
Appearance:	Clear colorless to light yellow liquid
Storage:	Flammables area
MDL:	MFCD00041419
LogP:	2.11440

Publication Number	Title	Priority Date
CN-113264816-A	Spiro [ cyclopropane-1, 2' -indene ] -1',3' -diketone derivative and synthetic method thereof	20210531
EP-3708565-A1	Pyrimidinyloxyphenylamidines and the use thereof as fungicides	20200304
US-2021147706-A1	Conductive structure having self-assembled protective layer and self-assembled coating composition	20191114
WO-2021065796-A1	Curable composition, cured material, and method for forming cured material	20191002
WO-2021054459-A1	Benzotriazole compound, light absorber, and resin composition	20190918

PMID	Publication Date	Title	Journal
19320427	20090505	STM imaging ortho- and para-fluorothiophenol self-assembled monolayers on Au(111)	Langmuir : the ACS journal of surfaces and colloids

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Related Functional Groups

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Sulfur Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[518012-62-9]
[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]p-toluenesulfonate
[2006276-82-8]
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[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[71996-48-0]
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[832739-83-0]
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GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Warning

Complexity:	74.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	128.00959950
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	128.00959950
Rotatable Bond Count:	0
Topological Polar Surface Area:	1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2