AC1LCXHK structure

AC1LCXHK

(8-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl) benzoate

Also Known As: Methyl 2-benzoyl-4,6-benzylidene-d-glucoside|Methyl 2-O-benzoyl-4,6-O-benzylidene-a-D-glucopyranoside|Methyl 2-O-Benzoyl-4,6-di-O-benzylidene- -D-glucopyranoside|Methyl 2-O-Benzoyl-4,6-di-O-benzylidene-a-D-glucopyranoside|(8-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl) benzoate

CAS: 28642-64-0
Molecular Formula C21H22O7
Molecular Weight 386.13657 g/mol
LogP 2.1
Topological Polar Surface Area 83.5 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 386.13657
Monoisotopic Mass 386.13657
Heavy Atoms 28
Complexity 515.0

Chemical Identifiers

CAS Number 28642-64-0
SMILES COC1C(C(C2C(O1)COC(O2)C3=CC=CC=C3)O)OC(=O)C4=CC=CC=C4
InChIKey WHKUKOCUXSRSAR-UHFFFAOYSA-N

Product Overview

AC1LCXHK (CAS 28642-64-0), with molecular formula C21H22O7 and molecular weight 386.13657 g/mol. IUPAC: (8-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl) benzoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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