Acetamide, N-(4-bromo-9,10-dihydro-9,10-dioxo-1-anthracenyl)-2-cyano-N-methyl-
Basic information
- CAS
141399-59-9- Standard SMILES
CN(C(=O)CC#N)c1ccc(Br)c2c1C(=O)c1ccccc1C2=O- InChIKey
IXMSAEUVILDDHT-UHFFFAOYSA-N- Molecular formula
- C18H11BrN2O3
- Average molar mass
- 383.2 g/mol
- Monoisotopic mass
- 381.9953
Names & identifiers
- Preferred name
- Acetamide, N-(4-bromo-9,10-dihydro-9,10-dioxo-1-anthracenyl)-2-cyano-N-methyl-
- IUPAC
- N-(4-bromo-9,10-dioxoanthracen-1-yl)-2-cyano-N-methylacetamide
Names & synonyms
141399-59-9Acetamide, N-(4-bromo-9,10-dihydro-9,10-dioxo-1-anthracenyl)-2-cyano-N-methyl-DTXSID90888970RefChem:551729DTXCID301028240IXMSAEUVILDDHT-UHFFFAOYSA-NN-(4-BROMO-9,10-DIOXO-9,10-DIHYDROANTHRACEN-1-YL)-2-CYANO-N-METHYLACETAMIDE
Database identifiers
- CAS
141399-59-9- PubChem CID
- 3034286
- DTXSID
DTXSID90888970- Nikkaji
- J1.566.077E
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 78.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 611
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 InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationAcetamide, N-(4-bromo-9,10-dihydro-9,10-dioxo-1-anthracenyl)-2-cyano-N-methyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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