2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl isothiocyanate

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Catalog Number

ACM14152977

Product Name

Structure

CAS

14152-97-7

Category

Heterocyclic Organic Compound

Synonyms

ZINC04202729, 14152-97-7

IUPAC Name

[(2S,3R,4S,5S,6R)-4,5-diacetyloxy-2-(acetyloxymethyl)-6-isothiocyanatooxan-3-yl] acetate

Molecular Weight

389.38

Molecular Formula

C₁₅H₁₉NO₉S

Canonical SMILES

CC(=O)OCC1C(C(C(C(O1)N=C=S)OC(=O)C)OC(=O)C)OC(=O)C

InChI Key

WOWNQYXIQWQJRJ-AIEDFZFUSA-N

Boiling Point

469.7ºC at 760 mmHg

Melting Point

114-116ºC(lit.)

Flash Point

237.8ºC

Density

1.4 g/cm³

Exact Mass

389.07800

Hazard Statements

Xn: Harmful;

H-Bond Acceptor

H-Bond Donor

Safety Description

22-26-36-45

WGK Germany

MSDS

COA

Spec Sheet

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