1-Propanone, 1,1'-(1,4-phenylene)bis[3-(dimethylamino)-
Basic information
- CAS
112169-33-2- Standard SMILES
CN(C)CCC(=O)c1ccc(C(=O)CCN(C)C)cc1- InChIKey
XHZSGPPAOYRXKQ-UHFFFAOYSA-N- Molecular formula
- C16H24N2O2
- Average molar mass
- 276.37 g/mol
- Monoisotopic mass
- 276.18377801
Names & identifiers
- Preferred name
- 1-Propanone, 1,1'-(1,4-phenylene)bis[3-(dimethylamino)-
- IUPAC
- 3-(dimethylamino)-1-[4-[3-(dimethylamino)propanoyl]phenyl]propan-1-one
Names & synonyms
1,1'-benzene-1,4-diylbis[3-(dimethylamino)propan-1-one]1-Propanone, 1,1'-(1,4-phenylene)bis[3-(dimethylamino)-112169-33-2CBDivE_002190SCHEMBL9509983DTXSID90331158XHZSGPPAOYRXKQ-UHFFFAOYSA-NSTL484942AKOS0374839771,4-bis(beta-dimethylaminopropionyl)benzene1,4-Bis[3-(dimethylamino)propionyl]benzene1,1'-(1,4-Phenylene)bis[3-(dimethylamino)propan-1-one]
Database identifiers
- CAS
112169-33-2- PubChem CID
- 435916
- DTXSID
DTXSID90331158
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 286
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Compound notes
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