Cetyltrimethylammonium bromide

Catalog	DGS57090
CAS	57-09-0
Structure
Synonyms	CTAB
IUPAC Name	hexadecyl(trimethyl)azanium;bromide
Molecular Weight	364.46
Molecular Formula	C19H42BrN
InChI	InChI=1S/C19H42N.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;/h5-19H2,1-4H3;1H/q+1;/p-1
InChI Key	LZZYPRNAOMGNLH-UHFFFAOYSA-M
Melting Point	243 °C
Flash Point	244 °C
Purity	≥99%
Solubility	Soluble in water
Appearance	White to off white powder
Complexity	181
EC Number	200-311-3
Exact Mass	363.25006
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isomeric SMILES	CCCCCCCCCCCCCCCC[N+](C)(C)C.[Br-]
MDL Number	MFCD00011772
Monoisotopic Mass	363.25006
Rotatable Bond Count	15
Storage Conditions	Room temperature
Topological Polar Surface Area	0 Ų