ChemicalBook--->CAS DataBase List--->619-80-7

619-80-7

619-80-7 Structure

619-80-7 Structure
IdentificationMore
[Name]

p-Nitrobenzamide
[CAS]

619-80-7
[Synonyms]

4-NITROBENZAMIDE
P-NITROBENZAMIDE
TIMTEC-BB SBB008201
4-nitro-benzamid
4-Nitrobenzoesαureamid
4-Nitrobenzoicacid,amide
Benzamide, p-nitro-
Benzamide,4-nitro-
Benzamide,p-nitro-
p-nitro-benzamid
4-Nitrobenzamide p-Nitrobenzamide
4-Nitrobenzamide>99.0%
4-Nitrobenzamide, 98+%
[EINECS(EC#)]

210-613-7
[Molecular Formula]

C7H6N2O3
[MDL Number]

MFCD00007994
[Molecular Weight]

166.13
[MOL File]

619-80-7.mol
Chemical PropertiesBack Directory
[Appearance]

white powder
[Melting point ]

199-201 °C(lit.)
[Boiling point ]

294.32°C (rough estimate)
[density ]

1.4334 (rough estimate)
[refractive index ]

1.5880 (estimate)
[form ]

powder to crystal
[pka]

15.02±0.50(Predicted)
[color ]

White to Orange to Green
[Stability:]

Stable. Incompatible with strong oxidizing agents, strong bases.
[Water Solubility ]

<0.01 g/100 mL at 18 ºC
[Detection Methods]

HPLC,NMR
[BRN ]

639263
[InChI]

InChI=1S/C7H6N2O3/c8-7(10)5-1-3-6(4-2-5)9(11)12/h1-4H,(H2,8,10)
[InChIKey]

ZESWUEBPRPGMTP-UHFFFAOYSA-N
[SMILES]

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

619-80-7(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzamide, 4-nitro-(619-80-7)
[EPA Substance Registry System]

619-80-7(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

T,Xn
[Risk Statements ]

R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R22:Harmful if swallowed.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S27:Take off immediately all contaminated clothing .
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[RTECS ]

CV5601000
[TSCA ]

Yes
[HS Code ]

29242990
Hazard InformationBack Directory
[General Description]

White powder.
[Reactivity Profile]

A nitrated amide. Organic amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx).
[Air & Water Reactions]

Insoluble in water.
[Fire Hazard]

Flash point data for this compound are not available, however, P-NITROBENZAMIDE is probably combustible.
[Chemical Properties]

white powder
[Uses]

4-Nitrobenzamide was used in the preparation of 4-nitrobenziminosulfurane.
[Synthesis Reference(s)]

Tetrahedron Letters, 36, p. 3469, 1995 DOI: 10.1016/0040-4039(95)00528-K
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

4-Nitrobenzamide(619-80-7).msds
Spectrum DetailBack Directory
[Spectrum Detail]

p-Nitrobenzamide(619-80-7)MS
p-Nitrobenzamide(619-80-7)1HNMR
p-Nitrobenzamide(619-80-7)IR1
p-Nitrobenzamide(619-80-7)IR2
p-Nitrobenzamide(619-80-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Nitrobenzamide, 98%(619-80-7)
[Alfa Aesar]

4-Nitrobenzamide, 98+%(619-80-7)
[Sigma Aldrich]

619-80-7(sigmaaldrich)
[TCI AMERICA]

4-Nitrobenzamide,>98.0%(T)(619-80-7)
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