Basic information
- CAS
30777-84-5- Standard SMILES
O=C1c2ccccc2C(=O)N1OCc1cccc([N+](=O)[O-])c1- InChIKey
MXLWOFFKIKAHTG-UHFFFAOYSA-N- Molecular formula
- C15H10N2O5
- Average molar mass
- 298.25 g/mol
- Monoisotopic mass
- 298.05897142
Names & identifiers
- Preferred name
- Phthalimide, N-(m-nitrobenzyloxy)-
- IUPAC
- 2-[(3-nitrophenyl)methoxy]isoindole-1,3-dione
- English name
- N-[(3-Nitrophenyl)methoxy]phthalimide
- Molecular formula
- C15H10N2O5
- Molecular weight
- 298.25
Names & synonyms
30777-84-5Phthalimide, N-(m-nitrobenzyloxy)-2-((3-nitrobenzyl)oxy)isoindoline-1,3-dioneN-(m-Nitrobenzyloxy)phthalimide2-[(3-nitrophenyl)methoxy]isoindole-1,3-dioneN-[(3-Nitrophenyl)methoxy]phthalimideNSC-1306792-[(3-nitrophenyl)methoxy]-2,3-dihydro-1H-isoindole-1,3-dione2-[(3-Nitrophenyl)methoxy]-1H-isoindole-1,3(2H)-dione1H-Isoindole-1,3(2H)-dione, 2-((3-nitrophenyl)methoxy)-1H-Isoindole-1,3(2H)-dione, 2-[(3-nitrophenyl)methoxy]-NSC 130679
Show more names
BRN 1494011NSC130679HD545Q8X8BSCHEMBL5532596N-(3-nitrobenzyloxy)phthalimideDTXSID60184794MXLWOFFKIKAHTG-UHFFFAOYSA-N1H-Isoindole-1, 2-[(3-nitrophenyl)methoxy]-
Database identifiers
- CAS
30777-84-5- PubChem CID
- 97531
- DTXSID
DTXSID60184794- UNII
- HD545Q8X8B
- Nikkaji
- J50.524B
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 451
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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