3,5-Difluorobenzenesulfonyl chloride - CAS 210532-25-5

Catalog:	BB016566
Product Name:	3,5-Difluorobenzenesulfonyl chloride
CAS:	210532-25-5
Synonyms:	3,5-difluorobenzenesulfonyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3,5-difluorobenzenesulfonyl chloride
Description:	3,5-Difluorobenzenesulfonyl chloride (CAS# 210532-25-5) is a useful research chemical.
Molecular Weight:	212.60
Molecular Formula:	C6H3ClF2O2S
Canonical SMILES:	C1=C(C=C(C=C1F)S(=O)(=O)Cl)F
InChI:	InChI=1S/C6H3ClF2O2S/c7-12(10,11)6-2-4(8)1-5(9)3-6/h1-3H
InChI Key:	IIQKIICAOXAXEJ-UHFFFAOYSA-N
Boiling Point:	231.9 °C at 760 mmHg
Melting Point:	57-59 °C
Purity:	95 %
Density:	1.58 g/cm³
MDL:	MFCD02091378
LogP:	2.97310

Publication Number	Title	Priority Date
CN-113264937-A	4-aminopyrazolo [3,4-d ] pyrimidine derivative and application thereof	20210608
CN-112552309-A	Psoralen benzene sulfonate derivative and application thereof	20201217
CN-113429356-A	Triazole sulfonamide derivative and application thereof in agriculture	20200323
WO-2021165346-A1	Gcn2 modulator compounds	20200217
WO-2021088859-A1	Indazole compound, pharmaceutical composition of same, and applications thereof	20191106

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Related Functional Groups

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Sulfur Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[2006276-82-8]
[3-(N,N-Dimethylsulfamoyl)phenyl]methanesulfonyl Chloride
[71996-48-0]
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[104496-91-5]
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[1005626-64-1]
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GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	239
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	211.9510345
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	211.9510345
Rotatable Bond Count:	1
Topological Polar Surface Area:	42.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1