1-(4-Ethylphenyl)piperazine
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Basic information
- CAS
68104-58-5- Standard SMILES
CCc1ccc(N2CCNCC2)cc1- InChIKey
GLJGLGNGUCOPBJ-UHFFFAOYSA-N- Molecular formula
- C12H18N2
- Average molar mass
- 190.28 g/mol
Names & identifiers
- Preferred name
- 1-(4-Ethylphenyl)piperazine
- IUPAC
- 1-(4-ethylphenyl)piperazine
- English name
- 1-(4-ETHYL-PHENYL)-PIPERAZINE
- Molecular formula
- C12H18N2
- Molecular weight
- 190.28
Names & synonyms
1-(4-ethylphenyl)piperazine68104-58-5MFCD05182245SCHEMBL300437SCHEMBL9499633GLJGLGNGUCOPBJ-UHFFFAOYSA-NTCA10458AKOS008140142DB-372923EN300-94939Z5942740421-(4-ETHYL-PHENYL)-PIPERAZINE
Show more names
Piperazine, 1-(4-ethylphenyl)-
Database identifiers
- CAS
68104-58-5- PubChem CID
- 3265804
- EC Number
- 880-898-6
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 156
Physicochemical properties
- Boiling point
- 332.6 · 332.6±30.0 °C(Predicted)
- Density
- 0.998 · 0.998±0.06 g/cm3(Predicted)
- pka
- 9 · 9.00±0.10(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
Upstream & downstream products
Upstream raw materials
Related reactions
3 records
Compound notes
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