4-Iodobut-1-ene - CAS 7766-51-0

Catalog:	BB056306
Product Name:	4-Iodobut-1-ene
CAS:	7766-51-0
Synonyms:	1-Iodo-3-butene; 3-Butenyl Iodide; 4-Iodo-1-butene; Homoallyl Iodide

Technical Data

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Patents

Computed Properties

IUPAC Name:	4-iodobut-1-ene
Description:	4-Iodobut-1-ene is a reagent in the design of cell-permeable stapled peptides which are used as HIV-1 integrase inhibitors. 4-Iodobut-1-ene is also used as a reagent in the synthesis of pyrrolopyridazines as novel DGAT1 inhibitors.
Molecular Weight:	182
Molecular Formula:	C4H7I
Canonical SMILES:	C=CCCI
InChI:	InChI=1S/C4H7I/c1-2-3-4-5/h2H,1,3-4H2
InChI Key:	VUSYNHBKPCGGCI-UHFFFAOYSA-N
References:	Long, Y., et al. J. Med. Chem., 56, 5601 (2013); Fox, B.M., et al. Bioorg. Med. Chem. Lett., 20, 6030 (2010).

Publication Number	Title	Priority Date
CN-112142927-A	Organic-inorganic nanoparticle composite water repellent agent and preparation and application methods thereof	20200904
JP-2022034837-A	Method for Producing Organic Polymer with Carbon-Carbon Triple Bond	20200819
US-2022041621-A1	Modulators of cystic fibrosis transmembrane conductance regulator	20200807
WO-2022032068-A1	Modulators of cystic fibrosis transmembrane conductance regulator	20200807
WO-2021088198-A1	Electronic telecommunications articles comprising crosslinked fluoropolymers and methods	20191104
WO-2021090111-A1	Fluoropolymer compositions comprising a curing agent with ethylenically unsaturated and electron donor groups, and substrates coated therewith	20191104
WO-2021091864-A1	Electronic telecommunications articles comprising crosslinked fluoropolmyers and methods	20191104
TW-202128849-A	Fluoropolymer compositions comprising curing agent with ethylenically unsaturated and electron donor groups, coated substrates and methods	20191104
CN-112574181-A	Preparation method and application of suvorexant intermediate	20190930
WO-2020255038-A1	Combination of hepatitis b virus (hbv) vaccines and pyridopyrimidine derivatives	20190618

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GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P261, P264, P270, P272, P280, P301+P316, P302+P352, P303+P361+P353, P321, P330, P333+P313, P362+P364, P370+P378, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	24.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	181.95925
Formal Charge:	0
Heavy Atom Count:	5
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	181.95925
Rotatable Bond Count:	2
Topological Polar Surface Area:	0Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6