1-(4-Iodophenyl)-1H-1,2,3-triazole - CAS 1101173-99-2

Catalog:	BB002594
Product Name:	1-(4-Iodophenyl)-1H-1,2,3-triazole
CAS:	1101173-99-2
Synonyms:	1-(4-iodophenyl)triazole; 1-(4-iodophenyl)triazole

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(4-iodophenyl)triazole
Description:	1-(4-Iodophenyl)-1H-1,2,3-triazole (CAS# 1101173-99-2 ) is a useful research chemical.
Molecular Weight:	271.06
Molecular Formula:	C8H6IN3
Canonical SMILES:	C1=CC(=CC=C1N2C=CN=N2)I
InChI:	InChI=1S/C8H6IN3/c9-7-1-3-8(4-2-7)12-6-5-10-11-12/h1-6H
InChI Key:	WULBKMITIQXMOJ-UHFFFAOYSA-N
LogP:	1.87190

Publication Number	Title	Priority Date
WO-2020233512-A1	Aromatic amine ar and bet targeting protein degradation chimera compound and use	20190517
AU-2008275595-A1	Derivatives of urea and related diamines, methods for their manufacture, and uses therefor	20070710
AU-2008275595-B2	Derivatives of urea and related diamines, methods for their manufacture, and uses therefor	20070710
CA-2692598-A1	Derivatives of urea and related diamines, methods for their manufacture, and uses therefor	20070710
EP-2176247-A2	Derivatives of urea and related diamines, methods for their manufacture, and uses therefor	20070710

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Complexity:	145
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	270.96064
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	270.96064
Rotatable Bond Count:	1
Topological Polar Surface Area:	30.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2