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ChemicalBook--->CAS DataBase List--->4769-97-5

4769-97-5

4769-97-5 Structure

4769-97-5 Structure
IdentificationMore
[Name]

4-Nitroindole
[CAS]

4769-97-5
[Synonyms]

4-NITRO-1H-INDOLE
4-NITROINDOLE
4-Nitorindole
Nitroindole,4-
4-Nitroindole 97%
4-NITROINDOLE 98+%
1H-Indole, 4-nitro-
[EINECS(EC#)]

689-317-9
[Molecular Formula]

C8H6N2O2
[MDL Number]

MFCD00010056
[Molecular Weight]

162.15
[MOL File]

4769-97-5.mol
Chemical PropertiesBack Directory
[Appearance]

Yellow Crystalline Solid
[Melting point ]

205-207 °C (lit.)
[Boiling point ]

288.82°C (rough estimate)
[density ]

1.3264 (rough estimate)
[refractive index ]

1.5770 (estimate)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[solubility ]

Acetone, Dichloromethane, Ethyl Acetate, Methanol
[form ]

Granular Powder
[pka]

14.76±0.30(Predicted)
[color ]

Yellow
[BRN ]

136022
[InChI]

InChI=1S/C8H6N2O2/c11-10(12)8-3-1-2-7-6(8)4-5-9-7/h1-5,9H
[InChIKey]

LAVZKLJDKGRZJG-UHFFFAOYSA-N
[SMILES]

N1C2=C(C([N+]([O-])=O)=CC=C2)C=C1
[CAS DataBase Reference]

4769-97-5(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R68:Possible risk of irreversible effects.
[Safety Statements ]

S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT, IRRITANT-HARMFUL
[HS Code ]

29339900
Hazard InformationBack Directory
[Chemical Properties]

Yellow Crystalline Solid
[Uses]

4-Nitroindole is an intermediate for the preparation of indole compounds useful in treatment of pain, inflammation.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Nitroindole(4769-97-5)MS
4-Nitroindole(4769-97-5)1HNMR
4-Nitroindole(4769-97-5)13CNMR
4-Nitroindole(4769-97-5)IR1
4-Nitroindole(4769-97-5)IR2
4-Nitroindole(4769-97-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Nitroindole, 98%(4769-97-5)
[Alfa Aesar]

4-Nitroindole, 97%(4769-97-5)
[Sigma Aldrich]

4769-97-5(sigmaaldrich)
[TCI AMERICA]

4-Nitroindole,>98.0%(GC)(4769-97-5)
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