Tetradecyltrimethylammonium chloride

C₁₇H₃₈ClNCAS 4574-04-3291.95 g/mol

Open in Covalent MOL file

Quaternary ammonium

Properties

Molecular formula: C₁₇H₃₈ClN
Molar mass: 291.95 g/mol
Exact mass: 291.2693 Da
logP: 2.40Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 13

Hazards

Warning

H315 Causes skin irritation95.8% of notifiers
H319 Causes serious eye irritation95.8% of notifiers
H335 May cause respiratory irritation91.7% of notifiers

Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

4574-04-3

SMILES

CCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]

InChIKey

CEYYIKYYFSTQRU-UHFFFAOYSA-M

InChI

InChI=1S/C17H38N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2,3)4;/h5-17H2,1-4H3;1H/q+1;/p-1

Weigh it out

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

Names and synonyms

12 names

1-Tetradecanaminium, N,N,N-trimethyl-, chloride (1:1)
Ammonium, trimethyltetradecyl-, chloride
1-Tetradecanaminium, N,N,N-trimethyl-, chloride
Trimethyltetradecylammonium chloride
Myristyltrimethylammonium chloride
Trimethylmyristylammonium chloride
MTAC
TTAC
FSM 24
N-Cetyl-N,N,N-trimethylammonium chloride
C 14TAC
C14TAC

Work with Tetradecyltrimethylammonium 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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Tetradecyltrimethylammonium bromide1119-97-7Salt

Similar compounds

Caprylyltrimethylammonium chloride10108-86-8100 % similar Decyltrimethylammonium chloride10108-87-9100 % similar Dodecyltrimethylammonium chloride112-00-5100 % similar Cetrimonium chloride112-02-7100 % similar Stearyltrimethylammonium chloride112-03-8100 % similar Dodecyltrimethylammonium bromide1119-94-474 % similar Octadecyltrimethylammonium bromide1120-02-174 % similar Decyltrimethylammonium bromide2082-84-074 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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