Basic information
- CAS
4116-90-9- Standard SMILES
CN1C(=O)c2cccc3c(Br)ccc(c23)C1=O- InChIKey
YOQFUJMBLJZBNE-UHFFFAOYSA-N- Molecular formula
- C13H8BrNO2
- Average molar mass
- 290.11 g/mol
- Monoisotopic mass
- 288.97384
Names & identifiers
- Preferred name
- 1H-Benz[de]isoquinoline-1,3(2H)-dione, 6-bromo-2-methyl-
- IUPAC
- 6-bromo-2-methylbenzo[de]isoquinoline-1,3-dione
- English name
- 6-bromo-2-methyl-1H-benz[de]isoquinoline-1,3(2H)-dione
- Molecular formula
- C13H8BrNO2
- Molecular weight
- 290.11
Names & synonyms
4116-90-91H-Benz[de]isoquinoline-1,3(2H)-dione, 6-bromo-2-methyl-6-bromo-2-methyl-1h-benz[de]isoquinoline-1,3(2h)-dione4-Bromonaphthalic methylimideEINECS 223-908-0DTXSID00633111H-Benz(de)isoquinoline-1,3(2H)-dione, 6-bromo-2-methyl-6-Bromo-2-methyl-1H-benz(de)isoquinoline-1,3(2H)-dioneRefChem:438035DTXCID8039873223-908-04-Bromo-N-methyl-1,8-naphthalimide
Show more names
4-Bromo-N-methyl-1,8-naphthalenedicarboximide2-Methyl-6-bromo-1H-benzo[de]isoquinoline-1,3(2H)-dione
6-bromo-2-methyl-1H-benzo[de]isoquinoline-1,3(2H)-dione6-bromo-2-methylbenzo[de]isoquinoline-1,3-dioneMFCD004460218-BRomo-3-methyl-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(12),5,7,9(13),10-pentaene-2,4-dione52TA8FK7AY6-Bromo-2-methyl-benzo[de]isoquinoline-1,3-dioneMLS001076002SCHEMBL4866412
Database identifiers
- CAS
4116-90-9- PubChem CID
- 77762
- DTXSID
DTXSID0063311
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- storage temp.
- Store at room temperature
- Appearance
- Off-white to light brown Solid
- InChI
- InChI=1S/C13H8BrNO2/c1-15-12(16)8-4-2-3-7-10(14)6-5-9(11(7)8)13(15)17/h2-6H,1H3
- InChIKey
- YOQFUJMBLJZBNE-UHFFFAOYSA-N
- SMILES
- C1(=O)C2=C3C(C(Br)=CC=C3C(=O)N1C)=CC=C2
- EPA Substance Registry System
- 1 H-Benz[de]isoquinoline-1,3 · 1H-Benz[de]isoquinoline-1,3(2H)-dione, 6-bromo-2-methyl- (4116-90-9)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
- 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Benz[de]isoquinoline-1,3(2H)-dione, 6-bromo-2-methyl-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers14 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
淄博茵泰医药科技有限公司18766946537 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
河南利恩化工产品有限公司03716091-9097 13383857418 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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