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40787-96-0

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40787-96-0 Structure

40787-96-0 Structure
IdentificationBack Directory
[Name]

3-BROMO-4-NITROANILINE
[CAS]

40787-96-0
[Synonyms]

3-BROMO-4-NITROANILINE
4-Nitro-3-bromoaniline
4-Amino-2-bromonitrobenzene
Benzenamine, 3-bromo-4-nitro-
[Molecular Formula]

C6H5BrN2O2
[MDL Number]

MFCD07783047
[MOL File]

40787-96-0.mol
[Molecular Weight]

217.02
Chemical PropertiesBack Directory
[Melting point ]

259 °C
[Boiling point ]

339.3±22.0 °C(Predicted)
[density ]

1.812±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C(protect from light)
[form ]

Powder
[pka]

-0.07±0.10(Predicted)
[Appearance]

Light yellow to yellow Solid
[InChI]

InChI=1S/C6H5BrN2O2/c7-5-3-4(8)1-2-6(5)9(10)11/h1-3H,8H2
[InChIKey]

RLAIFIDRVAAEBW-UHFFFAOYSA-N
[SMILES]

C1(N)=CC=C([N+]([O-])=O)C(Br)=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Note ]

Toxic
[HS Code ]

2921420090
Spectrum DetailBack Directory
[Spectrum Detail]

3-BROMO-4-NITROANILINE(40787-96-0)1HNMR
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