Basic information
- CAS
123529-03-3- Standard SMILES
CC(C)N=C(c1ccccc1)C(C)(C)CCCCl- InChIKey
JWXDOABQNLEIRF-UHFFFAOYSA-N- Molecular formula
- C16H24ClN
- Average molar mass
- 265.82 g/mol
- Monoisotopic mass
- 265.1597275
Names & identifiers
- Preferred name
- N-(5-Chloro-2,2-dimethyl-1-phenyl-pentylidene)isopropylamine
- IUPAC
- 5-chloro-2,2-dimethyl-1-phenyl-N-propan-2-ylpentan-1-imine
- English name
- N-(5-Chloro-2,2-dimethyl-1-phenyl-pentylidene)isopropylamine
- Molecular formula
- C16H24ClN
- Molecular weight
- 265.82
Names & synonyms
123529-03-3N-(5-Chloro-2,2-dimethyl-1-phenyl-pentylidene)isopropylamine5-chloro-2,2-dimethyl-1-phenyl-N-propan-2-ylpentan-1-imineDTXSID50336982JWXDOABQNLEIRF-SDXDJHTJSA-NN-[(E)-5-Chloro-2,2-dimethyl-1-phenylpentylidene]-2-propanamine #(1Z)-5-Chloro-2,2-dimethyl-1-phenyl-N-(propan-2-yl)pentan-1-imine
Database identifiers
- CAS
123529-03-3- PubChem CID
- 537698
- DTXSID
DTXSID50336982
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 12.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 262
Physicochemical properties
- Boiling point
- 340.688 · 340.688±34.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.958 · 0.958±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 6.583 · 6.583±0.50(predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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