N,N'-bis(2,4,6-trimethylphenyl)propanediamide
Basic information
- CAS
105678-72-6- Standard SMILES
Cc1cc(C)c(NC(=O)CC(=O)Nc2c(C)cc(C)cc2C)c(C)c1- InChIKey
IOFPIPAZSGBPEY-UHFFFAOYSA-N- Molecular formula
- C21H26N2O2
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.19942808
Names & identifiers
- Preferred name
- N,N'-bis(2,4,6-trimethylphenyl)propanediamide
- IUPAC
- N,N'-bis(2,4,6-trimethylphenyl)propanediamide
- English name
- N,N'-Bis(2,4,6-trimethylphenyl)propanediamide
- Molecular formula
- C21H26N2O2
- Molecular weight
- 338.44
Names & synonyms
105678-72-6N1,N3-DimesitylmalonamideN,N'-bis(2,4,6-trimethylphenyl)propanediamideN1,N3-Bis(2,4,6-trimethylphenyl)propanediamideOprea1_369596CBDivE_012226DTXSID701248197AKOS001035452SR-01000401435SR-01000401435-1N~1~,N~3~-Bis(2,4,6-trimethylphenyl)propanediamideF1708-0005
Show more names
Propanediamide, N1,N3-bis(2,4,6-trimethylphenyl)-
Database identifiers
- CAS
105678-72-6- PubChem CID
- 746178
- DTXSID
DTXSID701248197
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 413
Physicochemical properties
- Boiling point
- 515.5 · 515.5±38.0 °C(Predicted)
- Density
- 1.137 · 1.137±0.06 g/cm3(Predicted)
- pka
- 0.25 · 0.25±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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