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Trimethylpropylammonium

HCID 29385
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Basic information

CAS
20064-29-3
Standard SMILES
CCC[N+](C)(C)C
InChIKey
GSBKRFGXEJLVMI-UHFFFAOYSA-N
Molecular formula
C6H16N+
Average molar mass
102.2 g/mol
Monoisotopic mass
102.12827452

Overview

Nervonyl carnitine is a quaternary ammonium salt.

Names & identifiers

Preferred name
Trimethylpropylammonium
IUPAC
trimethyl(propyl)azanium

Names & synonyms

trimethyl(propyl)azaniumtrimethylpropylammonium1-Propanaminium, N,N,N-trimethyl-20064-29-3DTXSID30274873HV2H235Y36RefChem:933454DTXCID20226326N,N,N-Trimethyl-1-propanaminiumSCHEMBL160184SCHEMBL489676SCHEMBL489677
Show more names
SCHEMBL4940567SCHEMBL7263939n,n,n-trimethylpropan-1-aminiumCHEBI:183153NS00114832

Database identifiers

CAS
20064-29-3
PubChem CID
29385
DTXSID
DTXSID30274873
ChEBI
CHEBI:183153
UNII
HV2H235Y36
Nikkaji
J304.133F

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
7
Formal charge
1
Complexity
42.6

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes