Dodecyltrimethylammonium bromide

Catalog	DGS1119944
CAS	1119-94-4
Structure
Synonyms	n-Dodecyl trimethylammonium bromide; N,N,N-trimethyl-1-dodecanaminium bromide
IUPAC Name	dodecyl(trimethyl)azanium;bromide
Molecular Weight	308.34
Molecular Formula	C15H34BrN
Canonical SMILES	CCCCCCCCCCCC[N+](C)(C)C.[Br-]
InChI	InChI=1S/C15H34N.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4;/h5-15H2,1-4H3;1H/q+1;/p-1
InChI Key	XJWSAJYUBXQQDR-UHFFFAOYSA-M
Melting Point	246 °C
Flash Point	246°C
Purity	99%
Solubility	water, 995.5 mg/L @ 25 °C (est)
Appearance	White crystal powder
Application	Dodecyltrimethylammonium Bromide is a quaternary ammonium salt useful as paint strippers, foaming stabilizers, and bactericidal lotions.
Storage	Store below +30°C.
Complexity	135
EC Number	214-290-3
Exact Mass	307.18746
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isomeric SMILES	CCCCCCCCCCCC[N+](C)(C)C.[Br-]
MDL Number	MFCD00011767
Monoisotopic Mass	307.18746
Rotatable Bond Count	11
Stability	Stable under normal temperatures and pressures.
Storage Conditions	Room temperature
Topological Polar Surface Area	0 Ų