Basic information
- CAS
61725-13-1- Standard SMILES
O=C1c2ccccc2C2=Nc3cccc4cccc(c34)N12- InChIKey
XFYQEBBUVNLYBR-UHFFFAOYSA-N- Molecular formula
- C18H10N2O
- Average molar mass
- 270.3 g/mol
- Monoisotopic mass
- 270.07931294
Names & identifiers
- Preferred name
- Solvent Orange 60
- IUPAC
- 2,11-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(19),4,6,8,10,12,14,16(20),17-nonaen-3-one
- English name
- SOLVENT ORANGE 60
- Molecular formula
- C18H10N2O
- Molecular weight
- 270.2848
Names & synonyms
Show more names
Database identifiers
- CAS
61725-13-1、61969-47-9、6925-69-5- PubChem CID
- 81344
- DTXSID
DTXSID4064507- UNII
- 9P2ZLV19F4
- EC Number
- 230-049-5、612-336-0、612-926-8
- Nikkaji
- J265.965D
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 499
Physicochemical properties
- InChI
- InChI=1S/C18H10N2O/c21-18-13-8-2-1-7-12(13)17-19-14-9-3-5-11-6-4-10-15(16(11)14)20(17)18/h1-10H
- InChIKey
- XFYQEBBUVNLYBR-UHFFFAOYSA-N
- SMILES
- O=C1C2=C([H])C([H])=C([H])C([H])=C2C2=NC3=C([H])C([H])=C([H])C4C([H])=C([H])C([H])=C(C3=4)N21
- FDA UNII
- 9 P2ZLV19F4 · 9P2ZLV19F4
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 98% (2229 of 2274) of all reports.
Not Classified
Aggregated GHS information provided per 2274 reports by companies from 6 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: 12H-Phthaloperin-12-one
REACH registered substance: 12H-phthaloperin-12-one (EC: 230-049-5)
12H-Phthaloperin-12-one: Does not have an individual approval but may be used under an appropriate group standard
Chemistry & industry
Uses & manufacturing
Applications
UsesSolvent Orange (SO) 60 is a perinone-type dye that is often used in plastic materials such as spectacle frames and has been shown to cause contact allergy. Mainly used for polystyrene, ABS resin coloring.
Preparation methods
PreparationA preparation method for solvent orange 60, belonging to chemical industry field, manufactured by: mixing phthalic anhydride and 1, 8- naphthylenediamine with the mass ratio of 1:1 with 1-5% by mass of hydrochloric acid solution, polar organic solvent miscible with water and non-ionic active catalyst, stirring and heating to the refluxing state for reacting 8-15 hours, filtering, washing the filter cake with water till the pH value of the filtrate is neutral, drying to obtain the solvent orange 60, wherein the dosage of the hydrochloric acid solution is 10-20 times of the 1, 8- naphthylenediamine; the dosage of the polar organic solvent is 1-50% of the total amount of the reaction medium and the dosage of the catalyst is 0.01-2% of the total amount of the reaction medium. The method combines the advantages of good quality and low cost of water phase method.
Suppliers53 total
Related reactions
No reaction records under the current filter.
Compound notes
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