2,5-Dibromobenzenesulfonyl chloride - CAS 23886-64-8

Catalog:	BB018230
Product Name:	2,5-Dibromobenzenesulfonyl chloride
CAS:	23886-64-8
Synonyms:	2,5-dibromobenzenesulfonyl chloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2,5-dibromobenzenesulfonyl chloride
Description:	2,5-Dibromobenzenesulfonyl chloride (CAS# 23886-64-8) is a useful research chemical.
Molecular Weight:	334.41
Molecular Formula:	C6H3Br2ClO2S
Canonical SMILES:	C1=CC(=C(C=C1Br)S(=O)(=O)Cl)Br
InChI:	InChI=1S/C6H3Br2ClO2S/c7-4-1-2-5(8)6(3-4)12(9,10)11/h1-3H
InChI Key:	ZLMPLIWURYRGEB-UHFFFAOYSA-N
Boiling Point:	133 °C / 1 mmHg
Melting Point:	69-73 °C (lit.)
Purity:	95 %
Density:	2.11 g/cm³
MDL:	MFCD00060685
LogP:	4.21990

Publication Number	Title	Priority Date
CN-111620817-A	Novel blue thermal activity delayed fluorescent material and application thereof	20200604
WO-2019224667-A1	Indanes as nrf2 activators	20180523
EP-3796906-A1	Indanes as nrf2 activators	20180523
JP-2021524469-A	Indane as an NRF2 activator	20180523
EP-3555082-A1	Ether linked triazoles as nrf2 regulators	20161215

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Related Functional Groups

Sulfur Compounds

[518012-62-9]
[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]p-toluenesulfonate
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide
[162894-76-0]
2-Hydroxyethane-1-sulfonamide
[42729-26-0]
3-(Trifluoromethylthio)phenyl isothiocyanate
[832739-83-0]
3-[(4-Chlorophenyl)sulfonyl]-5-methoxyaniline
[862649-86-3]
3-[(4-Chlorophenyl)sulfonyl]-5-nitrophenol

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:	249
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	333.78885
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	331.79090
Rotatable Bond Count:	1
Topological Polar Surface Area:	42.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3