4,5-Diiodo-2-methylimidazole - CAS 73746-44-8

Catalog:	BB034907
Product Name:	4,5-Diiodo-2-methylimidazole
CAS:	73746-44-8
Synonyms:	4,5-diiodo-2-methyl-1H-imidazole; 4,5-diiodo-2-methyl-1H-imidazole

Technical Data

Patents

Computed Properties

IUPAC Name:	4,5-diiodo-2-methyl-1H-imidazole
Description:	4,5-Diiodo-2-methylimidazole (CAS# 73746-44-8) is a useful research chemical.
Molecular Weight:	333.90
Molecular Formula:	C4H4I2N2
Canonical SMILES:	CC1=NC(=C(N1)I)I
InChI:	InChI=1S/C4H4I2N2/c1-2-7-3(5)4(6)8-2/h1H3,(H,7,8)
InChI Key:	WFEZOLYJPCODOA-UHFFFAOYSA-N
Boiling Point:	434.9 °C at 760 mmHg
Density:	2.75 g/cm³
MDL:	MFCD00464337
LogP:	1.92730

Publication Number	Title	Priority Date
CN-109643752-A	Flexible piezoelectric and ferroelectricity halogenated imidazole crystal	20160412
EP-3443601-A1	Flexible piezoelectric and ferroelectric haloimidazole crystals	20160412
US-2019127331-A1	Flexible piezoelectric and ferroelectric haloimidazole crystals	20160412
WO-2017180721-A1	Flexible piezoelectric and ferroelectric haloimidazole crystals	20160412
US-11091443-B2	Flexible piezoelectric and ferroelectric haloimidazole crystals	20160412

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Complexity:	88.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	333.84639
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	333.84639
Rotatable Bond Count:	0
Topological Polar Surface Area:	28.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.5