Basic information
- CAS
17431-90-2- Standard SMILES
O=[N+]([O-])c1cccc2nc3ccccc3c(Cl)c12- InChIKey
JOUFIQVFVDNYRT-UHFFFAOYSA-N- Molecular formula
- C13H7ClN2O2
- Average molar mass
- 258.66 g/mol
- Monoisotopic mass
- 258.0196052
Names & identifiers
- Preferred name
- Acridine, 9-chloro-1-nitro-
- IUPAC
- 9-chloro-1-nitroacridine
- English name
- 9-Chloro-1-nitroacridine
- Molecular formula
- C13H7ClN2O2
- Molecular weight
- 258.66
Names & synonyms
9-Chloro-1-nitroacridine17431-90-2Acridine, 9-chloro-1-nitro-DTXSID70169815RefChem:317151DTXCID20923069-chloro-1-nitro-acridineSCHEMBL4155798JOUFIQVFVDNYRT-UHFFFAOYSA-N9-CHLORO-1-NITROACRIDINE(WXG02445)
Database identifiers
- CAS
17431-90-2- PubChem CID
- 146341
- DTXSID
DTXSID70169815- Nikkaji
- J3.026.457F
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 333
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
河南阿尔法化工有限公司0371-55051623 18137891487 · [email protected]
Related reactions
3 records
Compound notes
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