CAS
93856-89-4 Purity
96%
93856-89-4 Purity
96%
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Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate
CAS
93856-93-0
Catalog Number
ACM93856930
Category
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What is the molecular formula of Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate?
The molecular formula is C12H16N2O6.
When was Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate created?
It was created on July 11, 2007.
What is the IUPAC name of Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate?
The IUPAC name is ethyl N-[1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]carbamate.
What is the Canonical SMILES of Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate?
The Canonical SMILES is CCOC(=O)NC(CO)C(C1=CC=C(C=C1)[N+](=O)[O-])O.
What is the XLogP3 value of Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate?
The XLogP3 value is 0.7.
How many hydrogen bond donor counts does Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate have?
It has 3 hydrogen bond donor counts.
What is the topological polar surface area of Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate?
The topological polar surface area is 125?2.
How many heavy atoms are present in Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate?
There are 20 heavy atoms present.
Is the compound canonicalized for Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate?
Yes, the compound is canonicalized.
What is the exact mass of Ethyl[2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]-carbamate?
The exact mass is 284.10083623 g/mol.
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