CAS
93981-71-6 Purity
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93981-71-6 Purity
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![N-(17-Chloro-6,7,10,15,16,21-hexahydro-5,7,10,15,21-pentaoxo-5H-naphtho[2,3-h]naphth[2',3':6,7]indolo[2,3-a]acridin-1-yl)benzamide](https://resource.alfa-chemistry.com/structure/93981-73-8.gif)
![[2-[[2-Cyano-3-[4-(diethylamino)phenyl]-1-oxoallyl]oxy]ethyl](3-hydroxypropyl)dimethylammonium chloride](https://resource.alfa-chemistry.com/structure/93981-79-4.gif)
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[3-[[2-Cyano-3-[4-(diethylamino)phenyl]-1-oxoallyl]oxy]propyl](2-hydroxyethyl)dimethylammonium chloride
CAS
93981-78-3
Catalog Number
ACM93981783
Category
Other Products
Molecular Weight
409.95008
Molecular Formula
C21H32ClN3O3
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Specification
Synonyms
[3-[[2-cyano-3-[4-(diethylamino)phenyl]-1-oxoallyl]oxy]propyl](2-hydroxyethyl)dimethylammonium chloride
What is the molecular formula of the compound referenced?
The molecular formula of the compound is C21H32ClN3O3.
What are some synonyms of the compound?
Some synonyms of the compound are EINECS 301-165-4 and 93981-78-3.
When was the compound created and last modified?
The compound was created on April 28, 2006, and last modified on December 30, 2023.
What is the molecular weight of the compound?
The molecular weight of the compound is 409.9 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 3-[(E)-2-cyano-3-[4-(diethylamino)phenyl]prop-2-enoyl]oxypropyl-(2-hydroxyethyl)-dimethylazanium;chloride.
What is the InChIKey of the compound?
The InChIKey of the compound is AXTWRHHHMPIWSA-PXMDEAMVSA-M.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 6 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 73.6 Ų.
How many rotatable bond counts does the compound have?
The compound has 12 rotatable bond counts.
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