CAS No.27194-74-7,Propylene glycol monolaurate Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	27194-74-7
Name:	Propylene glycol monolaurate

Formula:	C₁₅H₃₀O₃
Molecular Weight:	258.397
Synonyms:	AI3-00968;Dodecanoic acid, monoester with 1,2-propanediol;Emalex PGML;Lauric acid, monoester with propane-1,2-diol;E 2580;Propylene glycol monododecanoate;1,2-Propanediol, monolaurate;Rikemal PL 100;Propyleneglycol monolaurate;Dodecanoic acid,esters,monoester with 1,2-propanediol;
EINECS:	248-315-4
Density:	0.931 g/cm³
Boiling Point:	362.5 °C at 760 mmHg
Flash Point:	139.3 °C
Solubility:	4.5mg/L at 20℃
Appearance:	Yellow paste
PSA:	46.53000
LogP:	3.83130

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Specification

The Propylene glycol monolaurate, with the CAS registry number 27194-74-7, is also known as Lauric acid, monoester with propane-1,2-diol. Its EINECS number is 248-315-4. This chemical's molecular formula is C₁₅H₃₀O₃ and molecular weight is 258.397. What's more, its systematic name is 2-hydroxypropyl dodecanoate.

Physical properties of Propylene glycol monolaurate are: (1)ACD/LogP: 5.01; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.01; (4)ACD/BCF (pH 5.5): 3772.04; (5)ACD/KOC (pH 5.5): 12638.83; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 14; (9)Polar Surface Area: 35.53 Å²; (10)Index of Refraction: 1.451; (11)Molar Refractivity: 74.81 cm³; (12)Molar Volume: 277.5 cm³; (13)Surface Tension: 33.5 dyne/cm; (14)Density: 0.931 g/cm³; (15)Flash Point: 139.3 °C; (16)Enthalpy of Vaporization: 70.43 kJ/mol; (17)Boiling Point: 362.5 °C at 760 mmHg; (18)Vapour Pressure: 1.01E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC(O)C)CCCCCCCCCCC
(2)InChI: InChI=1S/C15H30O3/c1-3-4-5-6-7-8-9-10-11-12-15(17)18-13-14(2)16/h14,16H,3-13H2,1-2H3
(3)InChIKey: BHIZVZJETFVJMJ-UHFFFAOYSA-N