Dodecylphosphocholine

Catalog	DGS29557515
CAS	29557-51-5
Structure
Synonyms	n-Dodecylphosphocholine
IUPAC Name	dodecyl 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight	351.5
Molecular Formula	C17H38NO4P
InChI	InChI=1S/C17H38NO4P/c1-5-6-7-8-9-10-11-12-13-14-16-21-23(19,20)22-17-15-18(2,3)4/h5-17H2,1-4H3
InChI Key	QBHFVMDLPTZDOI-UHFFFAOYSA-N
Melting Point	224-226 °C
Purity	≥95%
Solubility	DMF: 16 mg/mL; DMSO: 16 mg/mL; Ethanol: 15 mg/mL; PBS (pH 7.2): 25 mg/mL
Appearance	A crystalline solid
Complexity	310
Critical Micelle Concentration	1.5 mM
Exact Mass	351.25384569
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Hygroscopic	No
Isomeric SMILES	CCCCCCCCCCCCOP(=O)([O-])OCC[N+](C)(C)C
Light Sensitive	No
Monoisotopic Mass	351.25384569
Rotatable Bond Count	16
Shipping	Room temperature
Stability	≥2 years
Storage Conditions	-20 °C
Topological Polar Surface Area	58.6 Ų
XLogP3-AA	4.5