Lauryl phosphate (12751-23-4)

The Lauryl phosphate, with the cas registry number 12751-23-4, has the IUPAC name of dodecan-1-ol; phosphoric acid. This is a kind of light yellowish solid.

The physical properties of this chemical are as follows: (1)ACD/LogP: 5.13; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.13; (4)ACD/LogD (pH 7.4): 5.13; (5)ACD/BCF (pH 5.5): 4631.99; (6)ACD/BCF (pH 7.4): 4631.99; (7)ACD/KOC (pH 5.5): 14640.28; (8)ACD/KOC (pH 7.4): 14640.28; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 9.23; (13)Flash Point: 115.4 °C; (14)Enthalpy of Vaporization: 57.56 kJ/mol; (15)Boiling Point: 258 °C at 760 mmHg; (16)Vapour Pressure: 0.00209 mmHg at 25°C; (17)Exact Mass: 284.175261; (18)MonoIsotopic Mass: 284.175261; (19)Topological Polar Surface Area: 98; (20)Heavy Atom Count: 18; (21)Formal Charge: 0; (22)Complexity: 131.

As to its usage, it is widely applied in many ways. It could be used as the surface active agent in mildy wash, shower gel, shampoo and hand washing, and could also used as the preparation medium, softening agent and colouring agent.

In addition, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: CCCCCCCCCCCCO.OP(=O)(O)O
(2)InChI: InChI=1S/C12H26O.H3O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13;1-5(2,3)4/h13H,2-12H2,1H3;(H3,1,2,3,4)
(3)InChIKey: NRVKLGPGMZAWJE-UHFFFAOYSA-N