Basic information
- CAS
27714-50-7- Standard SMILES
CN(CCCc1cccc2ccccc12)Cc1ccccc1- InChIKey
LFMSXYWSQUNWJL-UHFFFAOYSA-N- Molecular formula
- C21H23N
- Average molar mass
- 289.4 g/mol
- Monoisotopic mass
- 289.18304974
Names & identifiers
- Preferred name
- 1-Naphthalenepropylamine, N-benzyl-N-methyl-
- IUPAC
- N-benzyl-N-methyl-3-naphthalen-1-ylpropan-1-amine
- English name
- N-Benzyl-N-methyl-1-naphthalene-1-propanamine
- Molecular formula
- C21H23N
- Molecular weight
- 289.41
Names & synonyms
BRN 27413511-NAPHTHALENEPROPYLAMINE, N-BENZYL-N-METHYL-N-Benzyl-N-methyl-1-naphthalenepropylamine27714-50-7DTXSID00182072RefChem:232319DTXCID10104563N-benzyl-N-methyl-3-(naphthalen-1-yl)propan-1-amineN-Benzyl-N-methyl-1-naphthalene-1-propanamine1-Naphthalenepropanamine, N-methyl-N-(phenylmethyl)-
Database identifiers
- CAS
27714-50-7- PubChem CID
- 33996
- DTXSID
DTXSID00182072- Nikkaji
- J58.180A
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 307
Physicochemical properties
- Boiling point
- 425.7 · 425.7±24.0 °C(Predicted)
- Density
- 1.056 · 1.056±0.06 g/cm3(Predicted)
- pka
- 8.57 · 8.57±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…