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Myristyl myristate
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Name

Myristyl myristate

 EINECS 221-787-9
CAS No. 3234-85-3 Density 0.859 g/cm3
PSA 26.30000 LogP 9.93180
Solubility N/A Melting Point 37-44oC
Formula C28H56O2 Boiling Point 462.2 °C at 760 mmHg
Molecular Weight 424.751 Flash Point 240.8 °C
Transport Information N/A Appearance Waxy solid
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 3234-85-3 (MYRISTYL MYRISTATE) Hazard Symbols N/A
Synonyms

Myristicacid, tetradecyl ester (7CI,8CI);1-Tetradecanol, myristate;Alkamuls MM/M;Ceraphyl 424;Cetiol MM;Crodamol MM;Cyclochem MM;Exceparl MY-M;Liponate MM;Tetradecyl myristate;Tetradecyl tetradecanoate;Myristyl myristate;

Article Data 18

Myristyl myristate Synthetic route

544-63-8

n-tetradecanoic acid

3234-85-3

myristic acid tetradecyl ester

Conditions
ConditionsYield
With hydrogen In neat (no solvent) at 20 - 200℃; under 6000.6 Torr; for 24h; Autoclave; High pressure;86%
112-72-1

1-Tetradecanol

544-63-8

n-tetradecanoic acid

3234-85-3

myristic acid tetradecyl ester

Conditions
ConditionsYield
With triphenylphosphine-sulfur trioxide adduct In neat (no solvent) at 110℃; for 2h; Green chemistry;85%
In m-xylene at 140℃; for 24h; Product distribution / selectivity;55 %Chromat.
With silcoat-Novozym 435 at 60℃; for 24h; Enzymatic reaction;
With lipase B Candida antarctica at 60 - 70℃; for 2h; Time; Molecular sieve; Schlenk technique; Enzymatic reaction;
112-72-1

1-Tetradecanol

3234-85-3

myristic acid tetradecyl ester

Conditions
ConditionsYield
With dihydridotetrakis(triphenylphosphine)ruthenium In 1,3,5-trimethyl-benzene at 180℃; for 24h;82%
With CuO/Cr2O3 at 230 - 270℃;
Rhodococcus equi In 2,2,4-trimethylpentane at 30℃; for 48h; Yield given;
112-72-1

1-Tetradecanol

112-64-1

tetradecanoyl chloride

3234-85-3

myristic acid tetradecyl ester

112-72-1

1-Tetradecanol

A

3234-85-3

myristic acid tetradecyl ester

B

544-63-8

n-tetradecanoic acid

Conditions
ConditionsYield
In tetrachloromethane at 30℃; for 48h; Product distribution; intact cells of Corynebacterium equi; other solvents, also in the presence of phosphate buffer;
With Oxone; sodium chloride In water; ethyl acetate at 20℃; for 5.5h;
112-72-1

1-Tetradecanol

copper-chromium-oxide

copper-chromium-oxide

3234-85-3

myristic acid tetradecyl ester

Conditions
ConditionsYield
at 230 - 270℃;
112-72-1

1-Tetradecanol

A

124-25-4

myristylaldehyde

B

3234-85-3

myristic acid tetradecyl ester

C

544-63-8

n-tetradecanoic acid

Conditions
ConditionsYield
With oxygen In n-heptane at 100℃; under 750.075 Torr; for 6h; Green chemistry;
With oxygen In decane at 120℃; under 750.075 Torr; for 6h; Catalytic behavior; Temperature;
112-72-1

1-Tetradecanol

A

124-25-4

myristylaldehyde

B

3234-85-3

myristic acid tetradecyl ester

Conditions
ConditionsYield
With oxygen In n-heptane at 80℃; under 750.075 Torr; for 6h; Temperature; Solvent; Green chemistry;
3234-85-3

myristic acid tetradecyl ester

112-72-1

1-Tetradecanol

Conditions
ConditionsYield
With hydrogen; C29H35BNOP2Ru at 60 - 100℃; under 7500.75 - 37503.8 Torr; for 5h; Catalytic behavior; Pressure; Reagent/catalyst; Autoclave;

Myristyl myristate Specification

Myristyl myristate has the IUPAC Name of Tetradecyl tetradecanoate and it is also called Myristic acid myristyl ester; Alkamuls mm/m; Ceraphyl 424; Ceraphyl424; Cetiol mm; Crodamol mm; Cyclochem mM. The extinguishing agent of Myristyl myristate (CAS NO.3234-85-3) are dry powder, foam, sand, carbon dioxide, water mist.  Myristyl myristate can be used in organic synthesis.

Physical properties about Myristyl myristate are: (1)ACD/LogP: 13.013; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 13.01; (4)ACD/LogD (pH 7.4): 13.01; (5)ACD/BCF (pH 5.5): 1000000.00; (6)ACD/BCF (pH 7.4): 1000000.00; (7)ACD/KOC (pH 5.5): 10000000.00 ; (8)ACD/KOC (pH 7.4): 10000000.00; (9)#H bond acceptors: 2; (10)#Freely Rotating Bonds: 26; (11)Index of Refraction: 1.453; (12)Molar Refractivity: 133.544 cm3; (13)Molar Volume: 494.207 cm3; (14)Polarizability: 52.941 10-24cm3; (15)Surface Tension: 31.5049991607666 dyne/cm; (16)Density: 0.859 g/cm3; (17)Flash Point: 240.825 °C; (18)Enthalpy of Vaporization: 72.319 kJ/mol; (19)Boiling Point: 462.191 °C at 760 mmHg

You can still convert the following datas into molecular structure:
(1)InChI=1S/C28H56O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-30-28(29)26-24-22-20-18-16-14-12-10-8-6-4-2/h3-27H2,1-2H3;
(2)InChIKey=DZKXJUASMGQEMA-UHFFFAOYSA-N;
(3)SmilesCCCCCCCCCCCCCCOC(CCCCCCCCCCCCC)=O;

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 14400mg/kg (14400mg/kg)   Journal of the American College of Toxicology. Vol. 9(2), Pg. 247, 1990.

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