cis-1,4-Diacetoxy-2-butene - CAS 25260-60-0

Name: cis-1,4-Diacetoxy-2-butene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB018827
Product Name:	cis-1,4-Diacetoxy-2-butene
CAS:	25260-60-0
Synonyms:	[(Z)-4-acetyloxybut-2-enyl] acetate

Technical Data

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Computed Properties

IUPAC Name:	[(Z)-4-acetyloxybut-2-enyl] acetate
Description:	cis-1,4-Diacetoxy-2-butene (CAS# 25260-60-0) is a useful research chemical.
Molecular Weight:	172.18
Molecular Formula:	C8H12O4
Canonical SMILES:	CC(=O)OCC=CCOC(=O)C
InChI:	InChI=1S/C8H12O4/c1-7(9)11-5-3-4-6-12-8(2)10/h3-4H,5-6H2,1-2H3/b4-3-
InChI Key:	VZUAUHWZIKOMFC-ARJAWSKDSA-N
Boiling Point:	120 °C (18 torr)
Density:	1.09 g/cm³
Appearance:	Colorless liquid
MDL:	MFCD00059339
LogP:	0.66880

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[51493-02-8]C5H10ClNO
N-Methyl-N-propylcarbamoyl Chloride
[87-88-7]C6H2Cl2O4
Chloranilic acid
[70199-62-1]C8H10ClNO
(4-Pyridyl)acetone Hydrochloride
[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid

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PMID	Publication Date	Title	Journal
18220390	20080220	Synthesis and activity of ruthenium olefin metathesis catalysts coordinated with thiazol-2-ylidene ligands	Journal of the American Chemical Society
18637651	20080101	Ruthenium-based olefin metathesis catalysts coordinated with unsymmetrical N-heterocyclic carbene ligands: synthesis, structure, and catalytic activity	Chemistry (Weinheim an der Bergstrasse, Germany)
16089454	20050817	Hydrogen-mediated reductive coupling of conjugated alkynes with ethyl (N-Sulfinyl)iminoacetates: synthesis of unnatural alpha-amino acids via rhodium-catalyzed C-C bond forming hydrogenation	Journal of the American Chemical Society
15901319	20050301	Diels-alder adducts of 3,6-dibromophencyclone with symmetrical 1,4-disubstituted-cis-2-butenes: comparisons with the adduct of phencyclone and N-benzylmaleimide, and one-dimensional and two-dimensional nuclear magnetic resonance studies and ab initio structure calculations	Applied spectroscopy

Complexity:	164
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	172.07355886
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	172.07355886
Rotatable Bond Count:	6
Topological Polar Surface Area:	52.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3