Tri-O-acetyl-D-glucal

Tri-O-acetyl-D-glucal is a chemical compound registered under number CAS 2873-29-2, with the molecular formula C₁₂H₁₆O₇, and a molar mass of 272.25 g/mol.

The molecule contains 35 atoms connected by 35 chemical bonds. The full systematic IUPAC name of this compound is [(2R,3S,4R)-3,4-diacetyloxy-3,4-dihydro-2H-pyran-2-yl]methyl acetate. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 0.2 (positive value, a lipophilic compound), polar surface area PSA = 88.1 Ų, 0 donors and 7 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Molecular formula	C12H16O7
Masa molowa	272.25 g/mol
IUPAC	[(2R,3S,4R)-3,4-diacetyloxy-3,4-dihydro-2H-pyran-2-yl]methyl acetate
SMILES	CC(=O)OC[C@@H]1[C@H]([C@@H](C=CO1)OC(=O)C)OC(=O)C
InChIKey	LLPWGHLVUPBSLP-UTUOFQBUSA-N
logP (XLogP3)	0.2
PSA	88.1 Ų
HBD / HBA	0 / 7
PubChem CID	CID 688303 ↗

Signal word: Warning

H302 — Działa szkodliwie po połknięciu

Tri-O-acetyl-D-glucal · 2873-29-2 · 3,4,6-tri-O-Acetyl-D-glucal · QR9TXM6ZW3 · RefChem:933305 · (2R,3S,4R)-2-(acetoxymethyl)-3,4-dihydro-2H-pyran-3,4-diyl diacetate · D-Glucal triacetate · MFCD00063253 · D-arabino-Hex-1-enitol, 1,5-anhydro-2-deoxy-, 3,4,6-triacetate · SCHEMBL62522 · [(2R,3S,4R)-3,4-bis(acetyloxy)-3,4-dihydro-2H-pyran-2-yl]methyl acetate · 3,4,6-Tri-O-acetyl-1,5-anhydro-2-deoxy-D-arabino-hex-1-enitol · Triacetyl-D-glucal · [(2R,3S,4R)-3,4-diacetyloxy-3,4-dihydro-2H-pyran-2-yl]methyl acetate · AKOS015919129

• 📊 PubChem CID 688303 — NIH
• 🔬 NIST WebBook — spektroskopia
• 🌐 Wikidata
• 💊 ChEMBL — bioaktywność