CAS
93842-81-0 Purity
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93842-81-0 Purity
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Diethylmethyl[2-[(2-methyl-1-oxoallyl)oxy]propyl]ammonium methyl sulfate
CAS
93842-88-7
Catalog Number
ACM93842887
Category
Other Products
Molecular Weight
325.4216
Molecular Formula
C12H24NO2.CH3O4S
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Specification
Density
g/cm³
What is the molecular formula of the compound mentioned in the reference?
The molecular formula is C13H27NO6S.
What is the synonym for the compound in the reference?
The synonym is Diethylmethyl[2-[(2-methyl-1-oxoallyl)oxy]propyl]ammonium methyl sulfate.
When was the compound created according to the reference?
The compound was created on July 12, 2012.
What is the InChIKey of the compound?
The InChIKey is SNYREQSRMWGUEK-UHFFFAOYSA-M.
What is the Canonical SMILES of the compound?
The Canonical SMILES is CC[N+](C)(CC)CC(C)OC(=O)C(=C)C.COS(=O)(=O)[O-].
What is the CAS number of the compound?
The CAS number is 93842-88-7.
How many hydrogen bond acceptors does the compound have?
The compound has 6 hydrogen bond acceptors.
What is the topological polar surface area of the compound?
The topological polar surface area is 101?2.
How many heavy atoms does the compound contain?
The compound contains 21 heavy atoms.
Is the compound canonicalized according to the reference?
Yes, the compound is canonicalized.
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