3-Fluorothiophenol - CAS 2557-77-9

Catalog:	BB018960
Product Name:	3-Fluorothiophenol
CAS:	2557-77-9
Synonyms:	3-fluorobenzenethiol

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-fluorobenzenethiol
Description:	3-Fluorothiophenol (CAS# 2557-77-9) is used in the synthesis of 2-(fluorophenylthio)benzylamines as inhibitors of 5-hydroxytryptamine and noradrenaline re-uptake in the brain. Potential antidepressants.
Molecular Weight:	128.17
Molecular Formula:	C6H5FS
Canonical SMILES:	C1=CC(=CC(=C1)S)F
InChI:	InChI=1S/C6H5FS/c7-5-2-1-3-6(8)4-5/h1-4,8H
InChI Key:	ZDEUGINAVLMAET-UHFFFAOYSA-N
Boiling Point:	170 °C
Purity:	98 %
Density:	1.517 g/cm³
Appearance:	Clear colorless to pale yellow liquid
MDL:	MFCD00040227
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
WO-2021121420-A1	Benzopyrazole compound and intermediate, preparation method, and application thereof	20191220
WO-2021119254-A1	Antagonists of the muscarinic acetylcholine receptor m4	20191210
WO-2021065796-A1	Curable composition, cured material, and method for forming cured material	20191002

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Fluorinated Building Blocks

[1006473-17-1]
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[2367-82-0]
1,2,3,5-Tetrafluorobenzene
[1820736-42-2]
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[479552-94-8]
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[351-28-0]
3'-Fluoroacetanilide

Other Pyrimidines

[1183749-69-0]
2-(pyrimidin-2-yloxy)phenol
[452-76-6]
2,4-Difluorotoluene
[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine
[451-46-7]
Ethyl 4-fluorobenzoate
[81290-20-2]
Trimethyl(trifluoromethyl)silane
[551-62-2]
1,2,3,4-Tetrafluorobenzene

Sulfur Compounds

[162894-76-0]
2-Hydroxyethane-1-sulfonamide
[1005626-64-1]
3-(1,3-Dimethylpyrazol-4-yl)-5-[(1-methylpyrazol-4-yl)methylidene]-2-sulfanylideneimidazolidin-4-one
[1778-09-2]
4'-(Methylthio)acetophenone
[52147-97-4]
trans-β-Styrenesulfonyl chloride
[1353995-46-6]
(R)-1-((2,4-Dichlorophenyl)sulfonyl)pyrrolidin-3-ol
[843673-72-3]
(R)-4-(1-((tert-Butoxycarbonyl)amino)-2-hydroxyethyl)phenyl trifluoromethanesulfonate

GHS Hazard Statement:	H226 (15.22%): 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:	2.4