CAS No.6205-69-2,2-ACETAMIDO-3,4,6-TRI-O-ACETYL-2-DEOXY-BETA-D-GLUCOPYRANOSYL AZIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	6205-69-2
Name:	2-ACETAMIDO-3,4,6-TRI-O-ACETYL-2-DEOXY-BETA-D-GLUCOPYRANOSYL AZIDE
Article Data:	64

Formula:	C₁₄H₂₀N₄O₈
Molecular Weight:	372.335
Synonyms:	Glucopyranosylazide, 2-acetamido-2-deoxy-, 3,4,6-triacetate, b-D- (8CI);Glucopyranosyl azide, 2-acetamido-2-deoxy-,triacetate (6CI,7CI);2-Acetamido-2-deoxy-3,4,6-tri-O-acetyl-b-D-glucopyranosyl azide;
EINECS:	612-938-3
Density:	1.2964 (rough estimate)
Melting Point:	128-130 °C
Boiling Point:	501.81°C (rough estimate)
Appearance:	white solid
Hazard Symbols:	Xi
Risk Codes:	R36/37/38
PSA:	166.98000
LogP:	-0.20354

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Specification

This chemical is called 2-Acetamido-2-deoxy-3,4,6-tri-O-acetyl-beta-D-glucopyranosyl azide, and it can also be named as (2R,3S,4R,5R,6R)-5-Acetamido-2-(acetoxymethyl)-6-azidotetrahydro-2H-pyran-3,4-diyl diacetate (non-preferred name). The CAS registry number of this chemical is 6205-69-2, and its product categories are Glycosyl Azides; Aminosugars; Biochemistry; Glucose; Glycosides; O-Substituted Sugars; Sugars; Carbohydrates & Derivatives. Additionally, this chemical is white solid, and it should be stored at the freezer temperature.

Other characteristics of the 2-Acetamido-2-deoxy-3,4,6-tri-O-acetyl-beta-D-glucopyranosyl azide can be summarised as followings: (1)ACD/LogP: 0.47; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 0.47; (4)ACD/LogD (pH 7.4): 0.47; (5)ACD/BCF (pH 5.5): 1.34; (6)ACD/BCF (pH 7.4): 1.34; (7)ACD/KOC (pH 5.5): 42.96; (8)ACD/KOC (pH 7.4): 42.96; (9)#H bond acceptors: 12; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 120.8 Å².

You can still convert the following datas into molecular structure:
1.SMILES: [N-]=[N+]=N\[C@@H]1O[C@@H]([C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1NC(=O)C)COC(=O)C
2.InChI: InChI=1/C14H20N4O8/c1-6(19)16-11-13(25-9(4)22)12(24-8(3)21)10(5-23-7(2)20)26-14(11)17-18-15/h10-14H,5H2,1-4H3,(H,16,19)/t10-,11-,12-,13-,14-/m1/s1
3.InChIKey: RMCFMPMNMQZHSF-DHGKCCLABE