Methyl propargyl ether - CAS 627-41-8

Catalog:	BB031774
Product Name:	Methyl propargyl ether
CAS:	627-41-8
Synonyms:	3-methoxyprop-1-yne

Technical Data

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Computed Properties

IUPAC Name:	3-methoxyprop-1-yne
Description:	Methyl propargyl ether (CAS# 627-41-8) is a useful research chemical.
Molecular Weight:	70.09
Molecular Formula:	C4H6O
Canonical SMILES:	COCC#C
InChI:	InChI=1S/C4H6O/c1-3-4-5-2/h1H,4H2,2H3
InChI Key:	YACFFSVYSPMSGS-UHFFFAOYSA-N
Boiling Point:	61-62 °C (lit.)
Purity:	> 95.0 % (GC)
Density:	0.83 g/cm³
Appearance:	Clear light yellow liquid
MDL:	MFCD00008578
LogP:	0.26600

Publication Number	Title	Priority Date
CN-111635312-A	Synthesis method of (E) -2-fluoroalkyl-3-butenoate compound	20200707
WO-2021127166-A1	Inhibitors of enl/af9 yeats	20191217
US-2021171543-A1	Mcl1 inhibitors	20191112
WO-2021096860-A1	Mcl1 inhibitors	20191112
CN-110627718-A	Synthesis method of (E) -beta-monofluoroalkyl-beta, gamma-unsaturated amide	20191028

PMID	Publication Date	Title	Journal
22332361	20110901	[Monomers containing 2'-o-alkoxymethyl groups as synthons for the synthesis of oligoribonucleotides by the phosphotriester method]	Bioorganicheskaia khimiia
17725354	20070919	trans-RhCl(CO)(PPh3)2-catalyzed monomeric and dimeric cycloisomerization of propargylic 2,3-dienoates. Establishment of alpha,beta-unsaturated delta-lactone rings by cyclometallation	Journal of the American Chemical Society
16052661	20051007	Reactivity of alkynes containing alpha-hydrogen atoms with a triruthenium hydrido carbonyl cluster: alkenyl versus allyl cluster derivatives	Chemistry (Weinheim an der Bergstrasse, Germany)
15858641	20050507	A new method for the synthesis of acyltitanium complexes and their application to copper-mediated acylmetallation of carbon-carbon multiple bonds in aqueous media	Organic & biomolecular chemistry
11843151	20020118	Metal-induced B-H activation: addition of acetylene, propyne, or 3-methoxypropyne to Rh(Cp), Ir(Cp), Ru(p-cymene), and Os(p-cymene) half-sandwich complexes containing a chelating 1,2-dicarba-closo-dodecaborane-1,2-dichalcogenolato ligand	Chemistry (Weinheim an der Bergstrasse, Germany)

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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, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	47.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	70.041864811
Formal Charge:	0
Heavy Atom Count:	5
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	70.041864811
Rotatable Bond Count:	1
Topological Polar Surface Area:	9.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2