tetradecyl tetradecanoate

• ChemBase ID: 104386
• Molecular Formular: C28H56O2
• Molecular Mass: 424.74304
• Monoisotopic Mass: 424.42803103
• SMILES: CCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCC
• Canonical SMILES: CCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCC
• InChI: 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
• InChIKey: DZKXJUASMGQEMA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetradecyl tetradecanoate
• IUPAC Traditional name: myristyl myristate
• Synonyms: Myristyl Myristate; MYRISTIC ACID MYRISTYL ESTER

Database IDs

• CAS Number: 3234-85-3
• EC Number: 221-787-9
• PubChem SID: 162091642
• PubChem CID: 18605

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 11.282926
• LogD (pH = 7.4): 11.282926
• Log P: 11.282926
• Molar Refractivity: 132.5343 cm^3
• Polarizability: 53.121334 Å^3
• Polar Surface Area: 26.3 Å^2
• Rotatable Bonds: 26
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Condition: 0°C, Desiccate
• RTECS: XB8625000

Product Information

• Purity: 99%

DETAILS

MP Biomedicals - 02155755

(Myristyl Myristate) Purity: 99% Crystalline