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CAS No.: | 16631-25-7 |
---|---|
Name: | Methyl 2-bromotetradecanoate |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C15H29BrO2 |
Molecular Weight: | 321.298 |
Synonyms: | Methyl2-bromo-1-tetradecanoate; |
EINECS: | 240-687-6 |
Density: | 1.095 g/cm3 |
Melting Point: | < 10oC |
Boiling Point: | 314.4 °C at 760 mmHg |
Flash Point: | 159.8 °C |
Appearance: | Yellow oil |
Hazard Symbols: | Xi |
PSA: | 26.30000 |
LogP: | 5.23390 |
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Molecular Structure of Methyl 2-bromotetradecanoate (16631-25-7):
EINECS: 240-687-6
IUPAC Name: Methyl 2-bromotetradecanoate
Molecular Formula: C15H29BrO2
Molecular Weight: 321.293560 g/mol
XLogP3-AA: 7.1
H-Bond Donor: 0
H-Bond Acceptor: 2
Canonical SMILES: CCCCCCCCCCCCC(C(=O)OC)Br
InChI: InChI=1S/C15H29BrO2/c1-3-4-5-6-7-8-9-10-11-12-13-14(16)15(17)18-2/h14H,3-13H2,1-2H3
InChIKey: NTDPLPAGWMERRU-UHFFFAOYSA-N
Index of Refraction: 1.464
Molar Refractivity: 81 cm3
Molar Volume: 293.1 cm3
Surface Tension: 33 dyne/cm
Density: 1.095 g/cm3
Flash Point: 159.8 °C
Boiling Point: 314.4 °C at 760 mmHg
Enthalpy of Vaporization: 55.55 kJ/mol
Vapour Pressure: 0.000468 mmHg at 25 °C
Water Solubility: 0.02409 mg/L at 25 °C
Methyl 2-bromotetradecanoate (16631-25-7) is also called Methyl 2-bromomyristate ; Tetradecanoic acid, 2-bromo-, methyl ester ; 2-Bromotetradecanoic acid methyl ester ; Myristate with appearance of light brown liquid. Methyl 2-bromotetradecanoate (16631-25-7) is often used in organic synthesis.