HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

O-(2-Chloroethyl)choline

HCID 53137
NotesReactions
Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
74886-55-8
Standard SMILES
C[N+](C)(C)CCOCCCl
InChIKey
OGQRKWZQPRDYJS-UHFFFAOYSA-N
Molecular formula
C7H17ClNO+
Average molar mass
166.67 g/mol
Monoisotopic mass
166.0998669

Overview

affect muscarinic & nicotinic receptors

Names & identifiers

Preferred name
O-(2-Chloroethyl)choline
IUPAC
2-(2-chloroethoxy)ethyl-trimethylazanium
English name
O-(2-chloroethyl)choline
Molecular weight
0

Names & synonyms

O-(2-Chloroethyl)choline(2-Chloroethyl)choline ether74886-55-8DTXSID30225865Ethanaminium, 2-(2-chloroethoxy)-N,N,N-trimethyl-RefChem:167076DTXCID601483562-(2-Chloroethoxy)-N,N,N-trimethylethan-1-aminium

Database identifiers

CAS
74886-55-8
PubChem CID
53137
DTXSID
DTXSID30225865

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
5
Heavy atoms
10
Formal charge
1
Complexity
80.2

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes