Basic information
- CAS
28082-56-6- Standard SMILES
CC(C)=CCC(=O)OC(Cc1ccccc1)(c1ccccc1)C(C)CN(C)C- InChIKey
WBOAWXDADOAJBQ-UHFFFAOYSA-N- Molecular formula
- C25H33NO2
- Average molar mass
- 379.5 g/mol
- Monoisotopic mass
- 379.2511293
Names & identifiers
- Preferred name
- [4-(Dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] 4-methylpent-3-enoate
- IUPAC
- [4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] 4-methylpent-3-enoate
Names & synonyms
28082-56-6NSC181944[4-(dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl] 4-methylpent-3-enoateDTXSID10330062NSC-1819444-(Dimethylamino)-3-methyl-1,2-diphenylbutan-2-yl 4-methylpent-3-enoate
Database identifiers
- CAS
28082-56-6- PubChem CID
- 426166
- DTXSID
DTXSID10330062
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 497
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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