3,5-Dichloroiodobenzene - CAS 3032-81-3

Name: 3,5-Dichloroiodobenzene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB020552
Product Name:	3,5-Dichloroiodobenzene
CAS:	3032-81-3
Synonyms:	1,3-dichloro-5-iodobenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1,3-dichloro-5-iodobenzene
Description:	3,5-Dichloroiodobenzene (CAS# 3032-81-3) is used as a glycolate oxidase inhibitors.
Molecular Weight:	272.90
Molecular Formula:	C6H3Cl2I
Canonical SMILES:	C1=C(C=C(C=C1Cl)I)Cl
InChI:	InChI=1S/C6H3Cl2I/c7-4-1-5(8)3-6(9)2-4/h1-3H
InChI Key:	AATPRMRVLQZEHB-UHFFFAOYSA-N
Boiling Point:	258.4 °C at 760 mmHg
Melting Point:	55-58 °C
Purity:	95 %
Density:	2.015 g/cm³
Appearance:	Pale yellow to pale orange crystals or powder
Storage:	Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
MDL:	MFCD00001047
LogP:	3.59800

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Related Functional Groups

Halides

[134005-20-2]C4H6I2
(Z)-1,3-Diiodo-2-butene
[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[199114-62-0]C10H9ClN2O
2-(Chloromethyl)-3-methylquinazolin-4(3H)-one
[1431966-58-3]C8H18Cl2F2N2O
2,2-Difluoro-N-(2-morpholin-4-ylethyl)ethanamine dihydrochloride
[452-76-6]C7H6F2
2,4-Difluorotoluene

GHS Hazard Statement:	H302 (22.22%): 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, P403+P233, P405, and P501
Signal Word:	Warning

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Complexity:	87.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	271.86565
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	271.86565
Rotatable Bond Count:	0
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.8