9(10H)-Acridinone, 4-nitro-1-(phenylthio)-
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Basic information
- CAS
21810-29-7- Standard SMILES
O=c1c2ccccc2[nH]c2c([N+](=O)[O-])ccc(Sc3ccccc3)c12- InChIKey
GXVKCZFAZONQGQ-UHFFFAOYSA-N- Molecular formula
- C19H12N2O3S
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.05686342
Names & identifiers
- Preferred name
- 9(10H)-Acridinone, 4-nitro-1-(phenylthio)-
- IUPAC
- 4-nitro-1-phenylsulfanyl-10H-acridin-9-one
- English name
- C.I. Disperse Yellow 122
- Molecular formula
- C19H12N2O3S
- Molecular weight
- 348.37518
Names & synonyms
9(10H)-Acridinone, 4-nitro-1-(phenylthio)-21810-29-7EINECS 244-587-3DTXSID1066730RefChem:548488DTXCID003655461968-68-1612-900-64-Nitro-1-(phenylthio)acridin-9(10H)-oneGXVKCZFAZONQGQ-UHFFFAOYSA-N4-Nitro-1-(phenylsulfanyl)acridin-9-olNS00021857
Show more names
Disperse Yellow 122C.I. Disperse Yellow 122C.I.Disperse Yellow 122:C.I.561700
Database identifiers
- CAS
21810-29-7、61968-68-1- PubChem CID
- 89064
- DTXSID
DTXSID1066730- EC Number
- 244-587-3、612-900-6
- Nikkaji
- J225.441G
Properties
Computed structural propertiesFilling in
- XLogP
- 4.9
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 517
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 InformationChemical: 9(10H)-Acridinone, 4-nitro-1-(phenylthio)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9(10H)-Acridinone, 4-nitro-1-(phenylthio)-: INACTIVE
Related reactions
0 records
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Compound notes
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