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Structure

2-Acetamido-2-Deoxy-alpha-d-glucopyranosyl chloride 3,4,6-triacetate

CAS
3068-34-6
Catalog Number
ACM3068346
Category
Other Products
Molecular Weight
365.76
Molecular Formula
C14H20ClNO8

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Specification

Synonyms
1-CHLORO-2-ACETAMIDO-2-DEOXY-3,4,6-TRI-O-ACETYL-ALPHA-D-GLUCOSE;2-ACETAMIDO-2-DEOXY-ALPHA-D-GLUCOPYRANOSYL CHLORIDE 3,4,6-TRIACETATE;2-ACETAMIDO-3,4,6-TRI-O-ACETYL-2-DEOXY-ALPHA-D-GLUCOPYRANOSYL CHLORIDE;2-ACETAMIDO-2-DEOXY-3,4,6-TRI-O-ACETYL-ALPHA-D-GLUCOPYRANOSYL CHLORIDE;ALPHA-ACETOCHLORO-D-GLUCOSAMINE;ACETOCHLORO-ALPHA-D-GLUCOSAMINE;CHLORO-2-ACETAMIDO-2-DEOXY-3,4,6-TRI-O-ACETYL-ALPHA-D-GLUCOPYRANOSE;2-Acetamido-2-deoxy-3,4,6-tri-O-acetyl-?D-glucopyranosyl chloride
Melting Point
>214°C (dec.)(lit.)
Density
1.32
Hazard Statements
Xn
Supplemental Hazard Statements
H302
Symbol
GHS07
What is the molecular formula of 2-Acetamido-2-Deoxy-alpha-d-glucopyranosyl chloride 3,4,6-triacetate?

The molecular formula is C14H20ClNO8.

What is the molecular weight of the compound?

The molecular weight is 365.76 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is [(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetyloxy-6-chlorooxan-2-yl]methyl acetate.

What are the synonyms for 2-Acetamido-2-Deoxy-alpha-d-glucopyranosyl chloride 3,4,6-triacetate?

Some synonyms include ALPHA-ACETOCHLORO-D-GLUCOSAMINE and 2-Acetamido-3,4,6-tri-O-acetyl-2-deoxy-alpha-D-glucopyranosyl chloride.

What is the Canonical SMILES of the compound?

The Canonical SMILES is CC(=O)NC1C(C(C(OC1Cl)COC(=O)C)OC(=O)C)OC(=O)C.

What is the InChIKey of the compound?

The InChIKey is NAYYKQAWUWXLPD-KSTCHIGDSA-N.

How many hydrogen bond donor counts are there in the compound?

There is 1 hydrogen bond donor count.

What is the XLogP3 value of the compound?

The XLogP3 value is 0.8.

What is the topological polar surface area of the compound?

The topological polar surface area is 117 2.

How many defined atom stereocenter counts are there in the compound?

There are 5 defined atom stereocenter counts.

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