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Structure

Glycine,N,N-bis(phenylsulfonyl)-,ethyl ester

CAS
94500-78-4
Catalog Number
ACM94500784
Category
Other Products
Molecular Formula
C16H17NO6S2

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Specification

Density
1.381g/cm³
What is the molecular formula of N,N-bis(phenylsulfonyl)-glycine ethyl ester?

The molecular formula is C16H17NO6S2.

What is the molecular weight of the compound?

The molecular weight is 383.4 g/mol.

When was the compound created and last modified?

It was created on 2005-03-26 and last modified on 2023-12-30.

What is the IUPAC name of N,N-bis(phenylsulfonyl)-glycine ethyl ester?

The IUPAC name is ethyl 2-[bis(benzenesulfonyl)amino]acetate.

What is the InChI of the compound?

The InChI is InChI=1S/C16H17NO6S2/c1-2-23-16(18)13-17(24(19,20)14-9-5-3-6-10-14)25(21,22)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3.

How many hydrogen bond acceptors does the compound have?

It has 7 hydrogen bond acceptors.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 2.5.

What is the topological polar surface area of the compound?

The topological polar surface area is 115 Ų.

How many rotatable bonds are present in the compound?

There are 8 rotatable bonds.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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