2-(2-(Pyridin-2-YL)ethyl)aniline
Basic information
- CAS
50385-28-9- Standard SMILES
Nc1ccccc1CCc1ccccn1- InChIKey
KDAOXFXGTWSXIF-UHFFFAOYSA-N- Molecular formula
- C13H14N2
- Average molar mass
- 198.26 g/mol
- Monoisotopic mass
- 198.11569846
Names & identifiers
- Preferred name
- 2-(2-(Pyridin-2-YL)ethyl)aniline
- IUPAC
- 2-(2-pyridin-2-ylethyl)aniline
- English name
- 2-(2-pyridin-2-ylethyl)aniline
- Molecular formula
- C13H14N2
- Molecular weight
- 198.26
Names & synonyms
50385-28-92-(2-pyridin-2-ylethyl)aniline2-(2-(PYRIDIN-2-YL)ETHYL)ANILINE2-[2-(pyridin-2-yl)ethyl]aniline2-[2-(2-pyridinyl)ethyl]aniline2-(2-aminophenethyl)pyridineMFCD05256417[2-(2-Pyridin-2-ylethyl)phenyl]amine2-(2-(2-pyridyl)ethyl)phenylamine2(o-aminophenethyl)pyridine2-(o-aminophenethyl)pyridineorb3143660
Show more names
-(2-pyridin-2-ylethyl)aniline[2-[2-(2-pyridyl)ethyl]phenyl]amineBenzenamine, 2-[2-(2-pyridinyl)ethyl]-2-[2-(2-pyridinyl)ethyl]aniline(SALTDATA: FREE)
SCHEMBL113275582-[2-(2-pyridyl)ethyl]anilineDTXSID10405860KDAOXFXGTWSXIF-UHFFFAOYSA-NALBB-006405SBB048198STK501243TYD-02998
Database identifiers
- CAS
50385-28-9- PubChem CID
- 4715422
- DTXSID
DTXSID10405860- Nikkaji
- J520.053I
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Melting point
- 58 · 58-60 °C
- Boiling point
- 329.324 · 329.324±22.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.111 · 1.111±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 2 · Storage temp. 2-8°C
- pka
- 5.389 · 5.389±0.10(predicted)
- Appearance
- Off-white to light yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
- Hazard Codes
- Xi
- Risk Statements
- 41 · 41
- Safety Statements
- 26 · 26-39
- HazardClass
- IRRITANT
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
- risk_code
- 41
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-39
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
Related reactions
21 records
Compound notes
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