2,5-Diacetoxy-2,5-dihydrofuran (Mixture of Isomers) (>90%) - CAS 7093-88-1

Catalog:	BB068393
Product Name:	2,5-Diacetoxy-2,5-dihydrofuran (Mixture of Isomers) (>90%)
CAS:	7093-88-1
Synonyms:	2,5-Dihydro-2,5-furandiol 2,5-Diacetate; 2,5-Dihydro-2,5-furandiol Diacetate; 2,5-Diacetoxy-2,5-dihydrofuran; 2,5-Dihydro-2,5-diacetoxyfuran; NSC 139998

Technical Data

IUPAC Name:	(5-acetyloxy-2,5-dihydrofuran-2-yl) acetate
Description:	2,5-Diacetoxy-2,5-dihydrofuran is used as a reagent to synthesize Mexicanin H, a biologically active sesquiterpene lactone that exhibits antiparasitic activity against Trypanosoma cruzi (a parasite that causes Chagas disease)
Molecular Weight:	186.16
Molecular Formula:	C8H10O5
Canonical SMILES:	CC(=O)OC1C=CC(O1)OC(=O)C
InChI:	InChI=1S/C8H10O5/c1-5(9)11-7-3-4-8(13-7)12-6(2)10/h3-4,7-8H,1-2H3
InChI Key:	FFLHFURRPPIZTQ-UHFFFAOYSA-N
Solubility:	Chloroform (Slightly), DMSO (Slightly), Ethyl Acetate (Slightly)
Appearance:	White to Light Yellow Oil to Low-Melting Solid
Storage:	- 86°C, Inert atmosphere, Light sensitive
References:	Jimenez-Ortiz, V., et al. Parasitology, 91, 170 (2005); Romo, J., et al. Tetrahedron Lett., No vol. given, 1029 (1966).

Complexity:	221
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	186.05282342
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	186.05282342
Rotatable Bond Count:	4
Topological Polar Surface Area:	61.8Å²
Undefined Atom Stereocenter Count:	2
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4