Ddmab

Catalog	DGS15163301
CAS	15163-30-1
Synonyms	N-Dodecyl-N,N-(dimethylammonio)butyrate
IUPAC Name	4-[dodecyl(dimethyl)azaniumyl]butanoate
Molecular Weight	299.50
Molecular Formula	C18H37NO2
InChI	InChI=1S/C18H37NO2/c1-4-5-6-7-8-9-10-11-12-13-16-19(2,3)17-14-15-18(20)21/h4-17H2,1-3H3
InChI Key	ZFVNBVQBIZJUEY-UHFFFAOYSA-N
Solubility	Soluble in water
Appearance	Crystalline
Complexity	246
EC Number	623-369-5
Exact Mass	299.282429423
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isomeric SMILES	CCCCCCCCCCCC[N+](C)(C)CCCC(=O)[O-]
Monoisotopic Mass	299.282429423
Rotatable Bond Count	14
Storage Conditions	Room temperature
Topological Polar Surface Area	40.1 Ų
XLogP3-AA	6.4