Basic information
- CAS
36617-38-6- Standard SMILES
CCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCC- InChIKey
QEIJVPZRDAHCHE-UHFFFAOYSA-N- Molecular formula
- C29H58O2
- Average molar mass
- 438.8 g/mol
- Monoisotopic mass
- 438.44368109
Names & identifiers
- Preferred name
- Tridecyl palmitate
- IUPAC
- tridecyl hexadecanoate
- English name
- tridecyl palmitate
- Molecular formula
- C29H58O2
- Molecular weight
- 438.77
Names & synonyms
Tridecyl palmitate36617-38-6tridecyl hexadecanoateU11UVI11NSNSC-152074tridecylpalmitateEINECS 253-130-7UNII-U11UVI11NSSCHEMBL6685204DTXSID20190093Hexadecanoic acid, tridecyl esterQEIJVPZRDAHCHE-UHFFFAOYSA-N
Show more names
Palmitic acid tridecyl esterHexadecanoic acid tridecyl ester
NSC152074NSC 152074NS00030064Q27290541
Database identifiers
- CAS
36617-38-6- PubChem CID
- 98602
- DTXSID
DTXSID20190093- UNII
- U11UVI11NS
- EC Number
- 253-130-7
- Nikkaji
- J332.326I
Properties
Computed structural properties
- XLogP
- 13.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 27
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 340
Physicochemical properties
- Boiling point
- 473.7 · 473.7±13.0 °C(Predicted)
- Density
- 0.859 · 0.859±0.06 g/cm3(Predicted)
- FDA UNII
- 11 UVI11NS · U11UVI11NS
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…