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Basic information
- CAS
2593-81-9- Standard SMILES
CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O- InChIKey
FWIZOFDVGZCRTB-UHFFFAOYSA-N- Molecular formula
- C9H6N2O4
- Average molar mass
- 206.15 g/mol
- Monoisotopic mass
- 206.03275668
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 2-methyl-4-nitro-
- IUPAC
- 2-methyl-4-nitroisoindole-1,3-dione
- English name
- N-Methyl-3-nitrophthalimide
- Molecular formula
- C9H6N2O4
- Molecular weight
- 206.15
Names & synonyms
2593-81-92-methyl-4-nitro-1h-isoindole-1,3(2h)-dione1H-Isoindole-1,3(2H)-dione, 2-methyl-4-nitro-AI3-28687NSC 58516DTXSID1062544RefChem:79893DTXCID3037414FWIZOFDVGZCRTB-UHFFFAOYSA-N2-methyl-4-nitroisoindoline-1,3-dione2-methyl-4-nitroisoindole-1,3-dione2-methyl-4-nitro-2,3-dihydro-1H-isoindole-1,3-dione
Show more names
3-Nitro-N-methylphthalimideNSC-58516N-Methyl-3-nitrophthalimideNSC585163-nitro-N-methylphthal-imideSCHEMBL516272SCHEMBL28322162SCHEMBL30708932
Database identifiers
- CAS
2593-81-9- PubChem CID
- 75772
- DTXSID
DTXSID1062544- UNII
- 8E823T5LR9
- Nikkaji
- J421.624E
Properties
Computed structural propertiesFilling in
- XLogP
- 0.7
- Topological polar surface area
- 83.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 335
Physicochemical properties
- FDA UNII
- 8 E823T5LR9 · 8E823T5LR9
- EPA Substance Registry System
- 1 H-Isoindole-1,3 · 1H-Isoindole-1,3(2H)-dione, 2-methyl-4-nitro- (2593-81-9)
- 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.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Isoindole-1,3(2H)-dione, 2-methyl-4-nitro-: ACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers2 total
天津林宸科技有限公司15122256084 15122256084 · [email protected]
上海腾彤化工科技有限公司17602173738 · [email protected]
Related reactions
5 records
Compound notes
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