Benzenesulfonyl fluoride - CAS 368-43-4

Catalog:	BB023105
Product Name:	Benzenesulfonyl fluoride
CAS:	368-43-4
Synonyms:	benzenesulfonyl fluoride

Technical Data

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Computed Properties

IUPAC Name:	benzenesulfonyl fluoride
Description:	Benzenesulfonyl fluoride (CAS# 368-43-4 ) is a useful research chemical.
Molecular Weight:	160.17
Molecular Formula:	C6H5FO2S
Canonical SMILES:	C1=CC=C(C=C1)S(=O)(=O)F
InChI:	InChI=1S/C6H5FO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H
InChI Key:	IDIPWEYIBKUDNY-UHFFFAOYSA-N
Boiling Point:	207-208 °C (lit.)
Density:	1.333 g/cm³
Appearance:	Colorless liquid
MDL:	MFCD00007412
LogP:	2.42560

Publication Number	Title	Priority Date
CN-113429487-A	Artificially synthesized protein capable of removing antibiotic resistance gene in water environment	20210621
CN-112174761-A	Fluorination method	20200923
CN-112029238-A	Environment-friendly epoxy resin material and preparation method thereof	20200914
CN-112110863-A	Sulfonyl fluoride compound, preparation method thereof and method for preparing sulfonamide compound through sulfonyl fluoride compound	20200827
CN-112121852-A	Catalyst composition and use of catalyst composition or catalyst for catalyzing nucleophilic substitution reaction	20200827

PMID	Publication Date	Title	Journal
31226285	20190901	Molecular dynamics simulations of the interaction of Mouse and Torpedo acetylcholinesterase with covalent inhibitors explain their differential reactivity: Implications for drug design	Chemico-biological interactions
22807282	20120827	Sulfonyl fluoride-based prosthetic compounds as potential 18F labelling agents	Chemistry (Weinheim an der Bergstrasse, Germany)
22461744	20120301	Mass spectrometry-based proteomics for translational research: a technical overview	The Yale journal of biology and medicine
22666619	20120101	Insulin receptor expression and activity in the brains of nondiabetic sporadic Alzheimer's disease cases	International journal of Alzheimer's disease
21753780	20111101	Inhibition of transcription factor specificity protein 1 alters the gene expression profile of keratinocytes leading to upregulation of kallikrein-related peptidases and thymic stromal lymphopoietin	The Journal of investigative dermatology

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Related Functional Groups

Sulfur Compounds

[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[6633-90-5]
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[42729-26-0]
3-(Trifluoromethylthio)phenyl isothiocyanate
[2170450-99-2]
4-Methyl-1-(phenylsulfonyl)-1H-indole-2-carbonitrile
[156-57-0]
Cysteamine hydrochloride
[6358-69-6]
8-Hydroxypyrene-1,3,6-trisulfonic acid trisodium salt

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H331 (90.7%): Toxic if inhaled [Danger Acute toxicity, inhalation]
Precautionary Statement:	P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	186
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	159.99942873
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	159.99942873
Rotatable Bond Count:	1
Topological Polar Surface Area:	42.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1