Acetobromo-alpha-D-glucuronic acid methyl ester structure

Acetobromo-alpha-D-glucuronic acid methyl ester

methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxane-2-carboxylate

Also Known As: Acetobromo-alpha-D-glucuronic acid methyl ester|Methyl acetobromo-alpha-D-glucuronate|zlchem 1315|(2R,3R,4S,5S,6S)-2-Bromo-6-(methoxycarbonyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate|Methyl|A-Acetobromoglucuronate|Acetobromo-|A-D-glucuronic acid methyl ester|KS-00000GXO|ZLE0091|Methyl acetobromo-|A-D-glucuronate|EINECS 244-203-4|AN-524|BROMOMETHYLTRIACETYL GLUCURONATE|CS-W008125|GS-6021|HY-W008125|Acetobromo-alpha-D-glucuronic acid, methyl ester|ACETOBROMO-A-D-GLUCURONIC ACID METHYL ESTER|Acetobromo-alpha-D-Glucoronic acid methyl ester|Acetobromo-I+/--D-glucuronic acid methyl ester|K-6076|Acetobromo- alpha -D-glucuronic acid methyl ester|Acetobromo-a-D-glucuronic acid methyl ester, 98%

CAS: 21085-72-3
Molecular Formula C13H17BrO9
Molecular Weight 396.00558 g/mol
LogP 0.07
Topological Polar Surface Area 114.43 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 9
Rotatable Bonds 4
Exact Mass 396.00558
Heavy Atoms 23
Complexity 491.8

Chemical Identifiers

CAS Number 21085-72-3
SMILES CC(=O)O[C@H]1[C@@H]([C@H](O[C@@H]([C@@H]1OC(=O)C)Br)C(=O)OC)OC(=O)C

Product Overview

Acetobromo-alpha-D-glucuronic acid methyl ester (CAS 21085-72-3), with molecular formula C13H17BrO9 and molecular weight 396.00558 g/mol. IUPAC: methyl (2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-bromooxane-2-carboxylate.

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