3-Iodo-2-methylpropene - CAS 3756-30-7

Catalog:	BB023339
Product Name:	3-Iodo-2-methylpropene
CAS:	3756-30-7
Synonyms:	3-iodo-2-methylprop-1-ene

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Computed Properties

IUPAC Name:	3-iodo-2-methylprop-1-ene
Description:	3-Iodo-2-methylpropene (CAS# 3756-30-7) is used as a reactant in the preparation of chroman-substituted, tetrahydroquinoline-substituted and thiochroman-substituted ureas and thioureas for their use as anticancer agents.
Molecular Weight:	182.00
Molecular Formula:	C4H7I
Canonical SMILES:	CC(=C)CI
InChI:	InChI=1S/C4H7I/c1-4(2)3-5/h1,3H2,2H3
InChI Key:	HVSJHYFLAANPJS-UHFFFAOYSA-N
MDL:	MFCD12026120
LogP:	1.99750

Publication Number	Title	Priority Date
WO-2021200342-A1	Polyoxyalkylene polymer mixture and curable composition	20200331
WO-2021182118-A1	Organic polymer, curable composition, and cured product	20200309
KR-20210079688-A	Allylarenes and a Method for Producing the Same	20191220
US-2021188739-A1	Method for producing arene compounds and arene compounds produced by the same	20191220
US-2021174983-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204

PMID	Publication Date	Title	Journal
11421769	20010629	Sequenced reactions with samarium(II) iodide. Sequential intramolecular Barbier cyclization/Grob fragmentation for the synthesis of medium-sized carbocycles	The Journal of organic chemistry

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GHS Hazard Statement:	H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P370+P378, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	38.9
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:	1
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7