2,4-Dibromothiophene - CAS 3140-92-9

Catalog:	BB020908
Product Name:	2,4-Dibromothiophene
CAS:	3140-92-9
Synonyms:	2,4-dibromothiophene

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Computed Properties

IUPAC Name:	2,4-dibromothiophene
Description:	2,4-Dibromothiophene (CAS# 3140-92-9) is a useful research chemical.
Molecular Weight:	241.93
Molecular Formula:	C4H2Br2S
Canonical SMILES:	C1=C(SC=C1Br)Br
InChI:	InChI=1S/C4H2Br2S/c5-3-1-4(6)7-2-3/h1-2H
InChI Key:	WAQFYSJKIRRXLP-UHFFFAOYSA-N
Boiling Point:	213.4 °C at 760 mmHg
Melting Point:	-30 °C
Purity:	95 %
Density:	2.16 g/cm³
Appearance:	Clear colorless to light brown liquid
Storage:	Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
MDL:	MFCD00043889
LogP:	3.27310

Publication Number	Title	Priority Date
WO-2021123237-A1	2-amino-n-(amino-oxo-aryl-lambda6-sulfanylidene)acetamide compounds and their therapeutic use	20191219
WO-2021097123-A1	Thiophene compounds with cyclic amides, and uses thereof	20191113
WO-2021070646-A1	Organic thin film transistor, polymer, composition, organic semiconductor film and compound	20191010
WO-2021060042-A1	Compound, composition, film, structural body, and electronic device	20190925
WO-2021054144-A1	Method for producing cyclic imide compound, composition, and compound	20190920

PMID	Publication Date	Title	Journal
22199704	20111201	3,5-Dibromo-2-[2,5-dibut-oxy-4-(3,5-dibromo-thio-phen-2-yl)phen-yl]thio-phene	Acta crystallographica. Section E, Structure reports online

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GHS Hazard Statement:	H301 (86.67%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	66.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	241.82235
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	239.82440
Rotatable Bond Count:	0
Topological Polar Surface Area:	28.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3