Basic information
- CAS
72894-22-5- Standard SMILES
CCOc1ccc2c3c(ccc(OCC)c13)C(=O)N(Cc1ccccc1)C2=O- InChIKey
FJHLVFINFGYXGU-UHFFFAOYSA-N- Molecular formula
- C23H21NO4
- Average molar mass
- 375.4 g/mol
- Monoisotopic mass
- 375.14705815
Names & identifiers
- Preferred name
- 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-(phenylmethyl)-
- IUPAC
- 2-benzyl-6,7-diethoxybenzo[de]isoquinoline-1,3-dione
- English name
- 6,7-diethoxy-2-(phenylmethyl)-1H-benz[de]isoquinoline-1,3(2H)-dione
- Molecular formula
- C23H21NO4
- Molecular weight
- 375.41714
Names & synonyms
EINECS 276-971-11H-Benz[de]isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-(phenylmethyl)-DTXSID508882341H-Benz(de)isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-(phenylmethyl)-6,7-Diethoxy-2-(phenylmethyl)-1H-benz(de)isoquinoline-1,3(2H)-dione6,7-diethoxy-2-(phenylmethyl)-1H-benz[de]isoquinoline-1,3(2H)-dioneRefChem:237415DTXCID401027514276-971-172894-22-5SCHEMBL11406835FJHLVFINFGYXGU-UHFFFAOYSA-N
Show more names
N-Benzyl-4,5-diethoxy-1,8-naphthalenedicarbimide2-Benzyl-6,7-diethoxy-2H-benzo[de]isoquinoline-1,3-dione6,7-Diethoxy-2-(phenylmethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
NS000627332-benzyl-6,7-diethoxy-1H-benzo[de]isoquinoline-1,3(2H)-dione
Database identifiers
- CAS
72894-22-5
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 535
Physicochemical properties
- EPA Substance Registry System
- 1 H-Benz[de]isoquinoline-1,3 · 1H-Benz[de]isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-(phenylmethyl)- (72894-22-5)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 1H-Benz[de]isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-(phenylmethyl)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Benz[de]isoquinoline-1,3(2H)-dione, 6,7-diethoxy-2-(phenylmethyl)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…