2-(2-(4-Methylpiperazin-1-yl)ethoxy)benzaldehyde
Basic information
- CAS
82625-37-4- Standard SMILES
CN1CCN(CCOc2ccccc2C=O)CC1- InChIKey
LPKVLSKAKVNXOV-UHFFFAOYSA-N- Molecular formula
- C14H20N2O2
- Average molar mass
- 248.32 g/mol
- Monoisotopic mass
- 248.15247789
Names & identifiers
- Preferred name
- 2-(2-(4-Methylpiperazin-1-yl)ethoxy)benzaldehyde
- IUPAC
- 2-[2-(4-methylpiperazin-1-yl)ethoxy]benzaldehyde
- English name
- 2-[2-(4-Methyl-piperazin-1-yl)-ethoxy]-benzaldehyde
- Molecular formula
- C14H20N2O2
- Molecular weight
- 248.32
Names & synonyms
82625-37-42-(2-(4-Methylpiperazin-1-yl)ethoxy)benzaldehyde2-[2-(4-methylpiperazin-1-yl)ethoxy]benzaldehyde2-[2-(4-Methyl-piperazin-1-yl)-ethoxy]-benzaldehyde2-[2-(4-methyl-1-piperazinyl)ethoxy]benzaldehydeDTXSID70424714AKOS000103732CS-0455830ST504014002-[2-(4-methylpiperazinyl)ethoxy]benzaldehydeAKOS BC-2104CHEMBRDG-BB 7746135
Show more names
Benzaldehyde, 2-[2-(4-methyl-1-piperazinyl)ethoxy]-2-[2-(4-methyl-1-piperazinyl)ethoxy]benzaldehyde(SALTDATA: HCl)
Database identifiers
- CAS
82625-37-4- PubChem CID
- 6504233
- DTXSID
DTXSID70424714
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 252
Physicochemical properties
- Hazard Codes
- Xi
- 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
- hazard_code
- Xi
- hazard_class
- IRRITANT
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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