Basic information
- CAS
6914-98-3- Standard SMILES
O=C1c2cccc3cccc(c23)C(=O)N1c1ccccc1- InChIKey
HWWBUBSEWUZCOC-UHFFFAOYSA-N- Molecular formula
- C18H11NO2
- Average molar mass
- 273.3 g/mol
- Monoisotopic mass
- 273.07897859
Names & identifiers
- Preferred name
- N-Phenyl-1,8-naphthalimide
- IUPAC
- 2-phenylbenzo[de]isoquinoline-1,3-dione
- English name
- N-Phenyl-1,8-naphthalenedicarbimide
- Molecular formula
- C18H11NO2
- Molecular weight
- 273.29
Names & synonyms
N-Phenylnaphthalimiden-phenyl-1,8-naphthalimide6914-98-3Naphthalimide, N-phenyl-1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-phenyl-1H-Benz(de)isoquinoline-1,3(2H)-dione, 2-phenyl-RefChem:164105HWWBUBSEWUZCOC-UHFFFAOYSA-N2-Phenyl-1H-benzo[de]isoquinoline-1,3(2H)-dione2-phenylbenzo[de]isoquinoline-1,3-dioneTimTec1_005918Oprea1_344300
Show more names
N-Phenylnaphthalene-1,8-dicarbimideN-Phenyl-1,8-naphthalenedicarbimide2-Phenyl-2H-benzo[de]isoquinoline-1,3-dione
SCHEMBL299841CHEMBL1917487SCHEMBL28079849DTXSID901311081HMS1550M22CCG-18445SBB043205STK765743
Database identifiers
- CAS
6914-98-3- PubChem CID
- 623407
- DTXSID
DTXSID901311081- ChEMBL
CHEMBL1917487- Nikkaji
- J109.609E
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 410
Physicochemical properties
- Melting point
- 199 · 199-200 °C
- Boiling point
- 495 · 495.0±18.0 °C(Predicted)
- Density
- 1.36 · 1.360±0.06 g/cm3(Predicted)
- pka
- 3.03 · 3.03±0.20(Predicted)
- Toxicity
- 0.46 mg/kg · TDLo ipr-mus: 0.46 mg/kg FRMCE855,319,2000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- TDLo ipr-mus: 0.46 mg/kg FRMCE855,319,2000
Chemistry & industry
Suppliers1 total
陕西星贝爱科生物科技有限责任公司029-13572876172 13572876172 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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