Basic information
- CAS
6115-05-5- Standard SMILES
c1ccc(CCN=C2CCCCC2)cc1- InChIKey
BUDXUAVBGQCXOR-UHFFFAOYSA-N- Molecular formula
- C14H19N
- Average molar mass
- 201.31 g/mol
- Monoisotopic mass
- 201.15174961
Names & identifiers
- Preferred name
- N-(2-Phenylethyl)cyclohexanimine
- IUPAC
- N-(2-phenylethyl)cyclohexanimine
- English name
- Benzeneethanamine, N-cyclohexylidene-
- Molecular formula
- C14H19N
- Molecular weight
- 201.31
Names & synonyms
N-CYCLOHEXYLIDENEBENZENEETHANAMINE6115-05-5N-(2-Phenylethyl)cyclohexanimineDTXSID50720802H60265Benzeneethanamine, N-cyclohexylidene-
Database identifiers
- CAS
6115-05-5- PubChem CID
- 57308552
- DTXSID
DTXSID50720802
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 12.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Boiling point
- 308.4 · 308.4±21.0 °C(Predicted)
- Density
- 0.97 · 0.97±0.1 g/cm3(Predicted)
- pka
- 7.71 · 7.71±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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