Naphthalen-1-yl Decanoate
Basic information
- CAS
52664-28-5- Standard SMILES
CCCCCCCCCC(=O)Oc1cccc2ccccc12- InChIKey
BHZDUUIJMMLTMB-UHFFFAOYSA-N- Molecular formula
- C20H26O2
- Average molar mass
- 298.4 g/mol
- Monoisotopic mass
- 298.19328007
Names & identifiers
- Preferred name
- Naphthalen-1-yl Decanoate
- IUPAC
- naphthalen-1-yl decanoate
- English name
- alpha-Naphthyl caprate
- Molecular formula
- C20H26O2
- Molecular weight
- 298.42
Names & synonyms
Naphthalen-1-yl Decanoate52664-28-5DTXSID40404149RefChem:365234DTXCID60355003ALPHA-NAPHTHYL CAPRATEnaphthylcaprateDecanoic acid 1-naphthyl esterSCHEMBL28887199DB-229780A-naphthyl caprate1-naphthyl decanoate
Show more names
capric acid 1-naphthyl esterDecanoic acid, 1-naphthalenyl ester
Database identifiers
- CAS
52664-28-5- PubChem CID
- 4549693
- DTXSID
DTXSID40404149
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 313
Physicochemical properties
- Boiling point
- 421.3 · 421.3±14.0 °C(Predicted)
- Density
- 1.017 · 1.017±0.06 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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