Basic information
- CAS
5465-39-4- Standard SMILES
CCN(CC)CCCOc1cc(C)ccc1C(C)C- InChIKey
QGBXXDNCIBSAOU-UHFFFAOYSA-N- Molecular formula
- C17H29NO
- Average molar mass
- 263.4 g/mol
- Monoisotopic mass
- 263.22491455
Names & identifiers
- Preferred name
- N,N-diethyl-3-(5-methyl-2-propan-2-ylphenoxy)propan-1-amine
- IUPAC
- N,N-diethyl-3-(5-methyl-2-propan-2-ylphenoxy)propan-1-amine
Names & synonyms
5465-39-4NSC29005DTXSID40282969NSC-29005AKOS002774625N,N-diethyl-3-[5-methyl-2-(propan-2-yl)phenoxy]propan-1-amine
Database identifiers
- CAS
5465-39-4- PubChem CID
- 232003
- DTXSID
DTXSID40282969
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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