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55682-48-9

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Basic Information
CAS No.: 55682-48-9
Name: 1,6-Anhydro-2-azido-2-deoxy-3,4-bis-O-(phenylmethyl)-beta-D-glucopyranose
Article Data: 17
Molecular Structure:
Molecular Structure of 55682-48-9 (1,6-Anhydro-2-azido-2-deoxy-3,4-bis-O-(phenylmethyl)-beta-D-glucopyranose)
Formula: C20H21N3O4
Molecular Weight: 367.404
Synonyms: 1,6-Anhydro-2-azido-2-deoxy-3,4-bis-O-(phenylmethyl)-beta-D-glucopyranose;
PSA: 86.67000
LogP: 3.04396
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Specification

The 1,6-Anhydro-2-azido-2-deoxy-3,4-bis-O-(phenylmethyl)-beta-D-glucopyranose, with the CAS number 55682-48-9, is also called b-D-Glucopyranose,1,6-anhydro-2-azido-2-deoxy-3,4-bis-O-(phenylmethyl)-. The systematic name is (1R,2S,3R,4R,5R)-4-azido-2,3-bis(benzyloxy)-6,8-dioxabicyclo[3.2.1]octane (non-preferred name). Its molecular formula is C20H21N3O4.

The properties of the chemical are: (1)ACD/LogP: 2.38; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 7; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 7; (6)Polar Surface Area: 49.28 Å2.

You can still convert the following datas into molecular structure:
(1)SMILES: [N-]=[N+]=N/[C@@H]4[C@@H](OCc1ccccc1)[C@H](OCc2ccccc2)[C@@H]3O[C@H]4OC3
(2)InChI: InChI=1/C20H21N3O4/c21-23-22-17-19(25-12-15-9-5-2-6-10-15)18(16-13-26-20(17)27-16)24-11-14-7-3-1-4-8-14/h1-10,16-20H,11-13H2/t16-,17-,18-,19-,20-/m1/s1
(3)InChIKey: WGZHSGODUTUPCP-LASHMREHBG