Basic information
- CAS
26432-74-6- Standard SMILES
Cc1ccc2c(c1)C(N1CCN(CCCO)CC1)Cc1ccccc1O2.O=C(O)/C=C\C(=O)O- InChIKey
SFEPMAXJBFLOIT-BTJKTKAUSA-N- Molecular formula
- C26H32N2O6
- Average molar mass
- 468.5 g/mol
- Monoisotopic mass
- 468.22603674
Names & identifiers
- Preferred name
- 1-Piperazinepropanol, 4-(10,11-dihydro-8-methyldibenz(b,f)oxepin-10-yl)-, maleate (1:1)
- IUPAC
- (Z)-but-2-enedioic acid;3-[4-(3-methyl-5,6-dihydrobenzo[b][1]benzoxepin-5-yl)piperazin-1-yl]propan-1-ol
Names & synonyms
1-Piperazinepropanol, 4-(10,11-dihydro-8-methyldibenz(b,f)oxepin-10-yl)-, maleate (1:1)26432-74-6RefChem:10566634-(10,11-Dihydro-8-methyldibenz(b,f)oxepin-10-yl)-1-piperazinepropanol maleate1-Piperazinepropanol, 4-(10,11-dihydro-8-methyldibenz(b,f)oxepin-10-yl)-, maleate (1:1) (salt)
Database identifiers
- CAS
26432-74-6- PubChem CID
- 6445293
Properties
Computed structural properties
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 557
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…