Basic information
- CAS
118202-68-9- Standard SMILES
CCCN(CCCl)C1CCc2cccc(OC)c2C1- InChIKey
JIGYZROREFQOJA-UHFFFAOYSA-N- Molecular formula
- C16H24ClNO
- Average molar mass
- 281.82 g/mol
- Monoisotopic mass
- 281.1546421
Names & identifiers
- Preferred name
- 8-Methoxy-2-(N-2-chloroethyl-N-n-propyl)aminotetralin
- IUPAC
- N-(2-chloroethyl)-8-methoxy-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
- English name
- 8-methoxy-2-(N-2-chloroethyl-N-n-propyl)aminotetralin
- Molecular formula
- C16H24ClNO
- Molecular weight
- 281.82
Names & synonyms
8-Meo-clepat118202-68-98-Methoxy-2-(N-2-chloroethyl-N-n-propyl)aminotetralinRefChem:107226N-(2-chloroethyl)-8-methoxy-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine8-MeO-CIEPATDTXSID60922633JIGYZROREFQOJA-UHFFFAOYSA-N2-Naphthalenamine, N-(2-chloroethyl)-1,2,3,4-tetrahydro-8-methoxy-N-propyl-
Database identifiers
- CAS
118202-68-9- PubChem CID
- 183772
- DTXSID
DTXSID60922633- Nikkaji
- J503.226A
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 261
Physicochemical properties
- Boiling point
- 376.5 · 376.5±42.0 °C(Predicted)
- Density
- 1.08 · 1.08±0.1 g/cm3(Predicted)
- pka
- 8.05 · 8.05±0.20(Predicted)
Related reactions
1 records
Compound notes
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