Trimethyl[1-methyl-2-[(1-oxoallyl)oxy]ethyl]ammonium methyl sulfate

CAS

93941-88-9

Catalog Number

ACM93941889

Category

Other Products

Molecular Weight

283.341840 [g/mol]

Molecular Formula

C9H18NO2.CH3O4S

MSDS COA Spec Sheet

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Specification

Synonyms

Trimethyl(1-methyl-2-((1-oxoallyl)oxy)ethyl)ammonium methyl sulphate, 93941-88-9, EINECS 300-537-3, AC1MI523, CTK3I8335, AG-H-85259, methyl sulfate; trimethyl(1-prop-2-enoyloxypropan-2-yl)azanium

IUPAC Name

methyl sulfate;trimethyl(1-prop-2-enoyloxypropan-2-yl)azanium

InChI Key

MXUSWWKXIPNEQJ-UHFFFAOYSA-M

Exact Mass

283.10900

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of the compound with PubChem CID 3038546?

The molecular formula is C10H21NO6S.

What is the molecular weight of the compound?

The molecular weight is 283.34 g/mol.

What are the synonyms for PubChem CID 3038546?

The synonyms include 93941-88-9, EINECS 300-537-3, Trimethyl(1-methyl-2-((1-oxoallyl)oxy)ethyl)ammonium methyl sulfate, and more.

When was the compound first created and last modified?

The compound was created on 2005-08-09 and last modified on 2023-12-30.

What are the InChI and InChIKey for the compound?

The InChI is InChI=1S/C9H18NO2.CH4O4S/c1-6-9(11)12-7-8(2)10(3,4)5;1-5-6(2,3)4/h6,8H,1,7H2,2-5H3;1H3,(H,2,3,4)/q+1;/p-1 and the InChIKey is MXUSWWKXIPNEQJ-UHFFFAOYSA-M.

How many hydrogen bond acceptor counts does the compound have?

The compound has 6 hydrogen bond acceptor counts.

What is the exact mass of the compound?

The exact mass is 283.10895856 g/mol.

How many rotatable bond counts does the compound have?

The compound has 5 rotatable bond counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 101 Å2.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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