Acryloyloxyethyltrimethylammonium chloride

C₈H₁₆ClNO₂CAS 44992-01-0193.67 g/mol

Open in Covalent MOL file

Alkene Ester Quaternary ammonium

Properties

Molecular formula: C₈H₁₆ClNO₂
Molar mass: 193.67 g/mol
Exact mass: 193.0870 Da
logP: -2.57Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Hazards

Warning

H302 Harmful if swallowed99.3% of notifiers
H317 May cause an allergic skin reaction52.7% of notifiers
H319 Causes serious eye irritation58.9% of notifiers
H332 Harmful if inhaled18.2% of notifiers

Aggregated from 406 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P333+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

44992-01-0

SMILES

C=CC(=O)OCC[N+](C)(C)C.[Cl-]

InChIKey

FZGFBJMPSHGTRQ-UHFFFAOYSA-M

InChI

InChI=1S/C8H16NO2.ClH/c1-5-8(10)11-7-6-9(2,3)4;/h5H,1,6-7H2,2-4H3;1H/q+1;/p-1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

23 names · show all

Ethanaminium, N,N,N-trimethyl-2-[(1-oxo-2-propen-1-yl)oxy]-, chloride (1:1)
Ethanaminium, N,N,N-trimethyl-2-[(1-oxo-2-propenyl)oxy]-, chloride
[2-(Acryloyloxy)ethyl]trimethylammonium chloride
2-(Dimethylamino)ethyl acrylate methochloride
(Trimethylammonio)ethyl acrylate chloride
Ageflex FA 1Q80MC
Adamquat MC 80
Adamquat MC 75
Dimethylaminoethyl acrylate methyl chloride
DMA-MC
DME-B
N-(2-Acryloyloxyethyl)-N,N,N-trimethylammonium chloride
DMAEA-Q
2-Trimethylammonioethyl acrylate chloride
Acryloxyethyltrimethylammonium chloride
2-(N,N-Dimethylamino)ethyl acrylate methyl chloride
Ageflex FA 1Q80MC500
ADAME-Q
2-Trimethylammoniumethyl acrylate chloride
2-(Acryloyloxy)-N,N,N-trimethylethanaminium chloride
Acryloxyethyltrimethylammonuim chloride
DMA 3Q
ADAME-Quat

Work with Acryloyloxyethyltrimethylammonium chloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethylene glycol diacrylate26570-48-957 % similar Acetylcholine chloride60-31-156 % similar Succinylcholine chloride71-27-254 % similar 1,4-Butylene glycol diacrylate1070-70-853 % similar 1,6-Hexanediol diacrylate13048-33-452 % similar Oxydiethylene diacrylate4074-88-852 % similar Methoxyethyl acrylate3121-61-751 % similar Polyethylene glycol methyl ether acrylate32171-39-451 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Piperidine-4-carboxylic acid ethyl ester hydrochloride147636-76-8 (R)-Piperidine-3-carboxylic acid ethyl ester hydrochloride37675-19-7 Methyl trans-4-aminocyclohexanecarboxylate hydrochloride61367-07-5 Piperidin-4-yl-acetic acid methyl ester hydrochloride81270-37-3

Elsewhere

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