Basic information
- CAS
19357-24-5- Standard SMILES
O=C1c2ccccc2C(=O)N1c1ccc(Oc2ccccc2)cc1- InChIKey
ATQNCYZXYKKCSS-UHFFFAOYSA-N- Molecular formula
- C20H13NO3
- Average molar mass
- 315.3 g/mol
- Monoisotopic mass
- 315.08954328
Names & identifiers
- Preferred name
- ST50217308
- IUPAC
- 2-(4-phenoxyphenyl)isoindole-1,3-dione
- English name
- 1H-Isoindole-1,3(2H)-dione, 2-(4-phenoxyphenyl)-
- Molecular formula
- C20H13NO3
- Molecular weight
- 315.32
Names & synonyms
19357-24-5ST50217308DTXSID00354171RefChem:381590DTXCID303052322-(4-phenoxyphenyl)-1H-isoindole-1,3(2H)-dione2-(4-Phenoxy-phenyl)-isoindole-1,3-dioneOprea1_425602Oprea1_7591661H-Isoindole-1,3(2H)-dione, 2-(4-phenoxyphenyl)-SCHEMBL133028802-(4-phenoxyphenyl)-2,3-dihydro-1H-isoindole-1,3-dione
Show more names
STK152854AKOS0007323852-(4-phenoxyphenyl)benzo[c]azoline-1,3-dioneSR-01000393014SR-01000393014-1
Database identifiers
- CAS
19357-24-5- PubChem CID
- 765459
- DTXSID
DTXSID00354171- Nikkaji
- J1.319.840C
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 453
Physicochemical properties
- Boiling point
- 499.9 · 499.9±47.0 °C(Predicted)
- Density
- 1.328 · 1.328±0.06 g/cm3(Predicted)
- pka
- -0.36 · -0.36±0.20(Predicted)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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