Methacrylylcholine

HCID 78739

Basic information

CAS
33611-56-2
Standard SMILES
C=C(C)C(=O)OCC[N+](C)(C)C
InChIKey
USFMMZYROHDWPJ-UHFFFAOYSA-N
Molecular formula
C9H18NO2+
Average molar mass
172.24 g/mol
Monoisotopic mass
172.13320524

Overview

RN given refers to parent cpd

Names & identifiers

Preferred name
Methacrylylcholine
IUPAC
trimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium
English name
methacrylylcholine
Molecular weight
0

Names & synonyms

Methacrylylcholine33611-56-22-(trimethylammonio)ethyl methacrylateAW7U7JQ47YDTXSID00187305N,N,N-Trimethyl-2-((2-methyl-1-oxo-2-propenyl)oxy)ethanaminiumTMAEMRefChem:925565DTXCID70109796trimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azaniumMethacryloylcholineSCHEMBL180003
Show more names
Trimethyl-2-methacryloyloxyethylaminium[2-(Methacryloyloxy)ethyl]trimethylaminiumTrimethyl[2-(2-methylpropenoyloxy)ethyl]aminiumN,N,N-Trimethyl-2-(methacryloyloxy)ethane-1-aminiumTrimethyl[2-(1-oxo-2-methyl-2-propenyloxy)ethyl]aminiumN,N,N-trimethyl-2-[(2-methyl-1-oxo-2-propenyl)oxy]-Ethanaminium
SCHEMBL9003854CHEMBL3305914SCHEMBL11048118USFMMZYROHDWPJ-UHFFFAOYSA-2-trimethylammonioethyl methacrylateCHOLINE, METHACRYLATE (ESTER)AKOS015895018beta methacryloxyethyl trimethyl ammonium

Database identifiers

CAS
33611-56-2
PubChem CID
78739
DTXSID
DTXSID00187305
ChEMBL
CHEMBL3305914
UNII
AW7U7JQ47Y
Nikkaji
J239.218F

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
12

Physicochemical properties

FDA UNII
7 U7JQ47Y · AW7U7JQ47Y

Chemistry & industry

Suppliers1 total

CHEMICAL LAND21[email protected]

Related reactions

3 records

Compound notes

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