Basic information
- CAS
4227-99-0- Standard SMILES
CCCCCCCCCCCC(=O)Oc1cccc2ccccc12- InChIKey
CJSQRFDKBOSEJH-UHFFFAOYSA-N- Molecular formula
- C22H30O2
- Average molar mass
- 326.5 g/mol
- Monoisotopic mass
- 326.2245802
Names & identifiers
- Preferred name
- Naphthalen-1-yl Dodecanoate
- IUPAC
- naphthalen-1-yl dodecanoate
- English name
- alpha-Naphthyl laurate
- Molecular formula
- C22H30O2
- Molecular weight
- 326.47
Names & synonyms
Naphthalen-1-yl Dodecanoate4227-99-0alpha-NAPHTHYL LAURATEDodecanoic acid 1-naphthyl esternaphthyl dodecanoate1-Naphthalenyl dodecanoateSCHEMBL4259480DTXSID80399449CJSQRFDKBOSEJH-UHFFFAOYSA-NAKOS024386322DB-050888ST51037379
Show more names
A-naphthyl laurate1-NAPHTHYL LAURATE1-NAPHTHYL DODECANOATEALPHA-NAPHTHYL LAURATE CRYSTALLINEDodecanoic acid, 1-naphthalenyl esterALPHA-NAPHTHYL LAURATE, ALPHA-NAPHTHOL FREE1-Naphthyl laurate, Dodecanoic acid 1-naphthyl ester
G48231EN300-18537384
Database identifiers
- CAS
4227-99-0- PubChem CID
- 4112759
- DTXSID
DTXSID80399449- Nikkaji
- J2.022.292A
Properties
Computed structural properties
- XLogP
- 7.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 339
Physicochemical properties
- Boiling point
- 447.6 · 447.6±14.0 °C(Predicted)
- Density
- 1 · 1.000±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
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
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