Basic information
- CAS
27609-22-9- Standard SMILES
CC(C)C(CCN(C)Cc1ccccc1)c1cccc2ccccc12- InChIKey
HYZBSKVYZNURHW-UHFFFAOYSA-N- Molecular formula
- C24H29N
- Average molar mass
- 331.5 g/mol
- Monoisotopic mass
- 331.22999993
Names & identifiers
- Preferred name
- 1-Naphthalenepropylamine, N-benzyl-gamma-isopropyl-N-methyl-
- IUPAC
- N-benzyl-N,4-dimethyl-3-naphthalen-1-ylpentan-1-amine
- English name
- N-Benzyl-γ-isopropyl-N-methyl-1-naphthalene-1-propanamine
- Molecular formula
- C24H29N
- Molecular weight
- 331.49
Names & synonyms
27609-22-91-NAPHTHALENEPROPYLAMINE, N-BENZYL-gamma-ISOPROPYL-N-METHYL-RefChem:1055989BRN 2756760N-Benzyl-N,4-dimethyl-3-(1-naphthyl)pentylaminePentylamine, N-benzyl-N,4-dimethyl-3-(1-naphthyl)-N-Benzyl-gamma-isopropyl-N-methyl-1-naphthalenepropylamineDTXSID60950279N-Benzyl-N,4-dimethyl-3-(naphthalen-1-yl)pentan-1-amineN-Benzyl-γ-isopropyl-N-methyl-1-naphthalene-1-propanamine1-Naphthalenepropanamine, N-methyl-γ-(1-methylethyl)-N-(phenylmethyl)-
Database identifiers
- CAS
27609-22-9- PubChem CID
- 33969
- DTXSID
DTXSID60950279- Nikkaji
- J42.429C
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- Boiling point
- 450.9 · 450.9±24.0 °C(Predicted)
- Density
- 1.021 · 1.021±0.06 g/cm3(Predicted)
- pka
- 8.61 · 8.61±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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