Triethylamine, 2-(1,2,3,4-tetrahydro-2-naphthyloxy)-
Basic information
- CAS
27078-48-4- Standard SMILES
CCN(CC)CCOC1CCc2ccccc2C1- InChIKey
SOJZMSRSNAKPPE-UHFFFAOYSA-N- Molecular formula
- C16H25NO
- Average molar mass
- 247.38 g/mol
- Monoisotopic mass
- 247.19361442
Names & identifiers
- Preferred name
- Triethylamine, 2-(1,2,3,4-tetrahydro-2-naphthyloxy)-
- IUPAC
- N,N-diethyl-2-(1,2,3,4-tetrahydronaphthalen-2-yloxy)ethanamine
- English name
- [2-(1,2,3,4-Tetrahydronaphthalen-2-yloxy)ethyl]diethylamine
- Molecular formula
- C16H25NO
- Molecular weight
- 247.38
Names & synonyms
BRN 33165852-(1,2,3,4-Tetrahydro-2-naphthyloxy)triethylamine27078-48-4Triethylamine, 2-(1,2,3,4-tetrahydro-2-naphthyloxy)-4-06-00-03863 (Beilstein Handbook Reference)RefChem:386193DTXSID90949838N,N-Diethyl-2-[(1,2,3,4-tetrahydronaphthalen-2-yl)oxy]ethan-1-amine[2-(1,2,3,4-Tetrahydronaphthalen-2-yloxy)ethyl]diethylamineEthanamine, N,N-diethyl-2-[(1,2,3,4-tetrahydro-2-naphthalenyl)oxy]-
Database identifiers
- CAS
27078-48-4- PubChem CID
- 213816
- DTXSID
DTXSID90949838- Nikkaji
- J58.259J
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 227
Physicochemical properties
- Boiling point
- 180 °C · 180 °C(Press: 19 Torr)
- Density
- 0.99 · 0.99±0.1 g/cm3(Predicted)
- pka
- 9.74 · 9.74±0.25(Predicted)
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Compound notes
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