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PK (finishing agent)

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Name

PK (finishing agent)

EINECS 254-414-3
CAS No. 39322-78-6 Density N/A
PSA 79.40000 LogP 4.45480
Solubility 53.3mg/L at 20℃ Melting Point N/A
Formula C12H26KO4P Boiling Point 385.5 °C at 760 mmHg
Molecular Weight 342.494861 Flash Point 187 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 39322-78-6 (Phosphoric acid, dodecyl ester, potassium salt) Hazard Symbols N/A
Synonyms

Emalox LPK;Phosphoric acid,esters,dodecyl ester,potassium salt;IT 1;Potassium lauryl phosphate;

 

PK (finishing agent) Specification

The PK (finishing agent), with CAS registry number 39322-78-6, has the systematic name of potassium dodecyl hydrogen phosphate. Besides this, it is also called Phosphoric acid, dodecyl ester, potassium salt. And the chemical formula of this chemical is C12H26KO4P. What's more, its EINECS is 254-414-3.

Physical properties of PK (finishing agent): (1)ACD/LogP: 4.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 12; (12)Polar Surface Area: 65.57 Å2; (13)Flash Point: 187 °C; (14)Enthalpy of Vaporization: 69.64 kJ/mol; (15)Boiling Point: 385.5 °C at 760 mmHg; (16)Vapour Pressure: 5.15E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [K+].[O-]P(=O)(OCCCCCCCCCCCC)O
(2)InChI: InChI=1/C12H27O4P.K/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;/h2-12H2,1H3,(H2,13,14,15);/q;+1/p-1
(3)InChIKey: MJHORFXTDAGQEU-REWHXWOFAA
(4)Std. InChI: InChI=1S/C12H27O4P.K/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15;/h2-12H2,1H3,(H2,13,14,15);/q;+1/p-1
(5)Std. InChIKey: MJHORFXTDAGQEU-UHFFFAOYSA-M

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