1,2-Diiodobenzene - CAS 615-42-9

Name: 1,2-Diiodobenzene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB031172
Product Name:	1,2-Diiodobenzene
CAS:	615-42-9
Synonyms:	1,2-diiodobenzene

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	1,2-diiodobenzene
Description:	1,2-Diiodobenzene (CAS# 615-42-9) can be used as an organic LED. It can also be used as an improved catalyst for Iodine(I/III)-Catalysed Intermolecular CXH Amination.
Molecular Weight:	329.90
Molecular Formula:	C6H4I2
Canonical SMILES:	C1=CC=C(C(=C1)I)I
InChI:	InChI=1S/C6H4I2/c7-5-3-1-2-4-6(5)8/h1-4H
InChI Key:	BBOLNFYSRZVALD-UHFFFAOYSA-N
Boiling Point:	152 °C (15 mmHg)
Melting Point:	>300 °C
Purity:	98 %
Density:	2.524 g/cm³
Appearance:	Clear yellow to brownish liquid
Storage:	Refrigerator (+4 °C)
MDL:	MFCD00001038
LogP:	2.89580
Vapor Pressure:	0.00593 [mmHg]

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Related Functional Groups

Halides

[859473-05-5]C9H6Cl2N2S
N-(3,4-Dichlorophenyl)-1,3-thiazol-2-amine
[1855911-19-1]C7H13BrClN3
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
[4860-03-1]C16H33Cl
1-Chlorohexadecane
[111-85-3]C8H17Cl
1-Chlorooctane
[73084-03-4]C11H18ClN3
2,4-di-tert-butyl-6-chloro-1,3,5-triazine
[4185-62-0]C10H6BrNO2
2-Bromo-1-nitronaphthalene

GHS Hazard Statement:	H315 (97.87%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021120838-A1	Organic compound, electronic device, and electronic apparatus	20191219
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US-2021167296-A1	Organic compound containing heterocyclic ring and having low lumo properties, and organic electroluminescent device using the same	20191203
US-2021161889-A1	Muscarinic acetylcholine m1 receptor antagonists	20191202
WO-2021095356-A1	Sulfonium salt, acid generator, resist composition, and method for producing device	20191112

PMID	Publication Date	Title	Journal
22095646	20111216	Remarkably selective recognition of iodobenzene derivatives by a macrocyclic bis-Pt(II) metallohost	Chemistry (Weinheim an der Bergstrasse, Germany)
20199094	20100402	Intramolecular direct C-H arylation approach to fused purines. Synthesis of purino[8,9-f]phenanthridines and 5,6-dihydropurino[8,9-a]isoquinolines	The Journal of organic chemistry
19174378	20090401	A preliminary assessment of the effects of ATI-2042 in subjects with paroxysmal atrial fibrillation using implanted pacemaker methodology	Europace : European pacing, arrhythmias, and cardiac electrophysiology : journal of the working groups on cardiac pacing, arrhythmias, and cardiac cellular electrophysiology of the European Society of Cardiology
19039371	20081221	A one-pot oxidative decarboxylation-Friedel-Crafts reaction of acyclic alpha-amino acid derivatives activated by the combination of iodobenzene diacetate/iodine and iron dust	Organic & biomolecular chemistry
19006408	20081119	Highly luminescent BODIPY-based organoboron polymer exhibiting supramolecular self-assemble structure	Journal of the American Chemical Society

Complexity:	62.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	329.84025
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	329.84025
Rotatable Bond Count:	0
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2