Hexadecanoic acid,2-hydroxy-, methyl ester supplier

Name
METHYL 2-HYDROXYHEXADECANOATE
EINECS
CAS No. 16742-51-1
Article Data8
CAS DataBase
Density 0.922 g/cm³
Solubility
Melting Point
Formula C₁₇H₃₄O₃
Boiling Point 330 °C at 760 mmHg
Molecular Weight 286.455
Flash Point 147.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Palmiticacid, a-hydroxy-, methyl ester (4CI);(?à)-Methyl 2-Hydroxyhexadecanoate;Methyl 2-hydroxyhexadecanoate;Methyl a-hydroxypalmitate;Dl-A-hydroxypalmitic acid methyl ester;
PSA 46.53000
LogP 4.61150

Hexadecanoic acid,2-hydroxy-, methyl ester Specification

The Hexadecanoic acid,2-hydroxy-, methyl ester, with the CAS registry number 16742-51-1, is also known as Dl-A-hydroxypalmitic acid methyl ester. This chemical's molecular formula is C₁₇H₃₄O₃ and molecular weight is 286.45. What's more, its systematic name is Methyl 2-hydroxyhexadecanoate. It should be stored 2-8 °C.

Physical properties about Hexadecanoic acid,2-hydroxy-, methyl ester are: (1)ACD/LogP: 6.19; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.19; (4)ACD/LogD (pH 7.4): 6.19; (5)ACD/BCF (pH 5.5): 29743.4; (6) ACD/BCF (pH 7.4): 29743.33; (7)ACD/KOC (pH 5.5): 55416.3; (8)ACD/KOC (pH 7.4): 55416.18; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 16; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.453; (14)Molar Refractivity: 84.07 cm³; (15)Molar Volume: 310.5 cm³; (16)Polarizability: 33.33×10^-24cm³; (17)Surface Tension: 33.5 dyne/cm; (18)Density: 0.922 g/cm³; (19)Flash Point: 147.1 °C; (20) Enthalpy of Vaporization: 66.34 kJ/mol; (21)Boiling Point: 330 °C at 760 mmHg; (22)Vapour Pressure: 1.26E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)C(O)CCCCCCCCCCCCCC
(2)InChI: InChI=1/C17H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(18)17(19)20-2/h16,18H,3-15H2,1-2H3
(3)InChIKey: LQZITXGTIYKQBJ-UHFFFAOYAO

Product Name

METHYL 2-HYDROXYHEXADECANOATE

Hexadecanoic acid,2-hydroxy-, methyl ester Specification

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