Methylenecyclobutane - CAS 1120-56-5

Catalog:	BB002860
Product Name:	Methylenecyclobutane
CAS:	1120-56-5
Synonyms:	methylidenecyclobutane

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Computed Properties

IUPAC Name:	methylidenecyclobutane
Description:	Methylenecyclobutane (CAS# 1120-56-5) is a useful research chemical compound.
Molecular Weight:	68.12
Molecular Formula:	C5H8
Canonical SMILES:	C=C1CCC1
InChI:	InChI=1S/C5H8/c1-5-3-2-4-5/h1-4H2
InChI Key:	QIRVGKYPAOQVNP-UHFFFAOYSA-N
Boiling Point:	42.2 °C at 760 mmHg
Purity:	> 95.0 % (GC)
Density:	0.736 g/mL at 25 °C (lit.)
Storage:	Refrigerator
MDL:	MFCD00001335
LogP:	1.72650

Publication Number	Title	Priority Date
WO-2021032492-A1	Fuel composition	20190816
WO-2021026099-A1	Kif18a inhibitors	20190802
WO-2021026100-A1	Pyridine derivatives as kif18a inhibitors	20190802
CN-110483344-A	One kind sulfone compound of beta-hydroxy containing naphthenic base and its synthetic method	20190726
CN-110483344-B	Cycloalkyl-containing beta-hydroxy sulfone compound and synthesis method thereof	20190726

PMID	Publication Date	Title	Journal
18842051	20081106	Enyne cross-metathesis with strained, geminally-substituted alkenes: direct access to highly substituted 1,3-dienes	Organic letters
17348667	20070329	PhI(OAc)2 -mediated novel 1,3-dipolar cycloaddition of methylenecyclopropanes (MCPs), vinylidenecyclopropanes (VCPs), and methylenecyclobutane (MCB) with phthalhydrazide	Organic letters
17288480	20070302	Synthesis, mechanism of formation, and dynamics of a highly fluorinated methylenecyclobutene	The Journal of organic chemistry
17042042	20070101	Silica gel triggered transformations of 3-methylenecyclopropylmethyl sulfonates to 3-methylenecyclobutyl analogues: experimental and computational studies	Chemistry (Weinheim an der Bergstrasse, Germany)
12495213	20020701	Synthesis of methylenecyclobutane analogues of nucleosides with axial chirality and their phosphoralaninates: a new pronucleotide effective against Epstein-Barr virus	Antiviral chemistry & chemotherapy

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Related Functional Groups

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Methylenecyclobutane
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(E)-3-Dimethylamino-1-phenyl-propenone

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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, P280, P303+P361+P353, P370+P378, P403+P235, and P501
Signal Word:	Danger

Complexity:	47.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	68.062600255
Formal Charge:	0
Heavy Atom Count:	5
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	68.062600255
Rotatable Bond Count:	0
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5