ChemicalBook--->CAS DataBase List--->82-34-8

82-34-8

82-34-8 Structure

82-34-8 Structure
IdentificationMore
[Name]

1-NITROANTHRAQUINONE
[CAS]

82-34-8
[Synonyms]

1-NITROANTHRAQUINONE
1-Nitoanthrapuinone
1-nitro-10-anthracenedione
1-Nitro-9,10-anthracenedione
1-nitroanthrachinon
1-nitro-anthraquinon
alpha-nitroanthraquinone
Nitroanthraquinone
1-nitroanthracene-9,10-dione
1-Nitro-9,10-anthraquinone
[EINECS(EC#)]

201-413-0
[Molecular Formula]

C14H7NO4
[MDL Number]

MFCD00019140
[Molecular Weight]

253.21
[MOL File]

82-34-8.mol
Chemical PropertiesBack Directory
[Appearance]

Yellow needles from AcOH;yellow plates by sublimation; soluble in EtOH and Et2O; slightly soluble in EtOAc, benzene and CHCl3; insoluble in water.
[Melting point ]

232.5~233.5℃
[Boiling point ]

270~271℃(933Pa)
[density ]

1.3146 (rough estimate)
[refractive index ]

1.4700 (estimate)
[Fp ]

243.3 ±18.5 ℃
[storage temp. ]

Sealed in dry,Room Temperature
[Water Solubility ]

Insoluble in water
[form ]

powder to crystal
[color ]

Light yellow to Brown
[InChI]

InChI=1S/C14H7NO4/c16-13-8-4-1-2-5-9(8)14(17)12-10(13)6-3-7-11(12)15(18)19/h1-7H
[InChIKey]

YCANAXVBJKNANM-UHFFFAOYSA-N
[SMILES]

C1([N+]([O-])=O)=C2C(C(=O)C3=C(C2=O)C=CC=C3)=CC=C1
[CAS DataBase Reference]

82-34-8(CAS DataBase Reference)
[EPA Substance Registry System]

9,10-Anthracenedione, 1-nitro- (82-34-8)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P280-P305+P351+P338
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S22:Do not breathe dust .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RTECS ]

CB7940000
[TSCA ]

TSCA listed
[HS Code ]

2914.69.9000
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Anthracene
[Preparation Products]

1-Hydroxy anthraquinone-->1-Chloro anthraquinone-->1-Anthraquinonesulfonic acid-->Disperse Red 9-->ANTHRAQUINONE-1-DIAZONIUM CHLORIDE
Hazard InformationBack Directory
[Hazard]

Hepatotoxic; moderately toxic; may cause hepatocellular neoplasms, subcutaneous fibromas, subcutaneous hemangiosarcomas, and type II pneumocyte proliferation.
[Chemical Properties]

Yellow needles from AcOH;yellow plates by sublimation; soluble in EtOH and Et2O; slightly soluble in EtOAc, benzene and CHCl3; insoluble in water.
[Uses]

1-Nitroanthraquinone is used in the manufacture of various dyes, pharmaceuticals and similar products, either directly or after reduction to l-aminoanthraquinone.
[Synthesis Reference(s)]

Tetrahedron Letters, 16, p. 1429, 1975 DOI: 10.1016/S0040-4039(00)72160-5
[Synthesis]

1-Nitroanthraquinone is prepared by nitration of anthraquinone in nitric acid (danger of explosion!) , sulfuric acid , organic solvents , phosphoric acid , or hydrogen fluoride .
Purification from organic solvents by addition of bases, such as amines , alcoholates , or hydrazine , or from water by addition of sodium sulfite . 1-Nitroanthraquinone is crystallized from nitric acid , from organic solvents, for example, nitrobenzene , or from amides . The resulting 1-nitroanthraquinone may be finally purified by high-temperature distillation , .
Spectrum DetailBack Directory
[Spectrum Detail]

1-NITROANTHRAQUINONE(82-34-8)1HNMR
Well-known Reagent Company Product InformationBack Directory
[TCI AMERICA]

1-Nitroanthraquinone,>80.0%(GC)(82-34-8)
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