CAS
93777-11-8 Purity
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93777-11-8 Purity
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Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride
CAS
93777-18-5
Catalog Number
ACM93777185
Category
Other Products
Molecular Weight
484.111440 [g/mol]
Molecular Formula
C27H46ClNO4
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Specification
Synonyms
EINECS 298-047-7, Bis(2-(acetoxy)ethyl)benzyldodecylammonium chloride, 93777-18-5
IUPAC Name
bis(2-acetyloxyethyl)-benzyl-dodecylazanium chloride
InChI Key
XBEANSGDACVEFX-UHFFFAOYSA-M
H-Bond Acceptor
5
H-Bond Donor
0
What is the molecular formula of Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride?
The molecular formula is C27H46ClNO4.
What is the molecular weight of Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride?
The molecular weight is 484.1 g/mol.
When was Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride created and last modified?
It was created on 2007-12-05 and last modified on 2023-12-30.
What is the IUPAC name of Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride?
The IUPAC name is bis(2-acetyloxyethyl)-benzyl-dodecylazanium;chloride.
What is the InChIKey of Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride?
The InChIKey is XBEANSGDACVEFX-UHFFFAOYSA-M.
What is the canonical SMILES of Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride?
The canonical SMILES is CCCCCCCCCCCC[N+](CCOC(=O)C)(CCOC(=O)C)CC1=CC=CC=C1.[Cl-].
What is the CAS number for Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride?
The CAS number is 93777-18-5.
How many hydrogen bond acceptor counts does Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride have?
It has 5 hydrogen bond acceptor counts.
What is the topological polar surface area of Bis[2-(acetoxy)ethyl]benzyldodecylammonium chloride?
The topological polar surface area is 52.6 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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