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1-Bromo-3-chloro-2-iodobenzene

1-Bromo-3-chloro-2-iodobenzene - CAS 450412-28-9

Name: 1-Bromo-3-chloro-2-iodobenzene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB025752
Product Name:	1-Bromo-3-chloro-2-iodobenzene
CAS:	450412-28-9
Synonyms:	1-bromo-3-chloro-2-iodobenzene; 1-bromo-3-chloro-2-iodobenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-bromo-3-chloro-2-iodobenzene
Description:	1-Bromo-3-chloro-2-iodobenzene (CAS# 450412-28-9) is a useful research chemical.
Molecular Weight:	317.35
Molecular Formula:	C6H3BrClI
Canonical SMILES:	C1=CC(=C(C(=C1)Br)I)Cl
InChI:	InChI=1S/C6H3BrClI/c7-4-2-1-3-5(8)6(4)9/h1-3H
InChI Key:	GIMVCZMZRZGDTL-UHFFFAOYSA-N
Boiling Point:	285.9 °C at 760 mmHg
Density:	2.272 g/cm³
Appearance:	White to yellow solid
MDL:	MFCD09907935
LogP:	3.70710

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Related Functional Groups

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-112300055-A	Nitrogen-containing compound, electronic component, and electronic device	20201028
CN-112110849-A	Nitrogen-containing compound, and electronic element and electronic device using same	20201021
CN-113024569-A	Organic electroluminescent compounds, various host materials and organic electroluminescent device comprising the same	20191224
DE-102020132076-A1	ORGANIC ELECTROLUMINESCENT COMPOUND, MULTIPLE HOST MATERIALS, AND THIS COMPREHENSIVE ORGANIC ELECTROLUMINESCENT DEVICE	20191224
JP-2021103769-A	Organic electroluminescent compounds, multiple host materials, and organic electroluminescent devices containing them	20191224

Complexity:	99.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	315.81514
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	315.81514
Rotatable Bond Count:	0
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.9