ChemicalBook--->CAS DataBase List--->614-21-1

614-21-1

614-21-1 Structure

614-21-1 Structure
IdentificationBack Directory
[Name]

BENZOYLNITROMETHANE
[CAS]

614-21-1
[Synonyms]

AKOS B022283
BENZOYLNITROMETHANE
Benzoylnitromethane,98%
ALPHA-NITROACETOPHENONE
BenzoylnitroMethane 98%
1-Phenyl-2-nitroethanone
Nitromethylphenyl ketone
Benzoylnitromethane, GC 98%
BenzoylnitroMethane, 98% 5GR
Benzoylnitromethanealpha-Nitroacetophenone
[Molecular Formula]

C8H7NO3
[MDL Number]

MFCD00010218
[MOL File]

614-21-1.mol
[Molecular Weight]

165.15
Chemical PropertiesBack Directory
[Appearance]

white waxy crystalline powder or flakes
[Melting point ]

105-107 °C(lit.)
[Boiling point ]

292.97°C (rough estimate)
[density ]

1.3450 (rough estimate)
[refractive index ]

1.5468 (estimate)
[storage temp. ]

Refrigerator (+4°C)
[form ]

Liquid
[pka]

5.37±0.29(Predicted)
[color ]

Clear colorless or yellow to red to brown
[InChI]

1S/C8H7NO3/c10-8(6-9(11)12)7-4-2-1-3-5-7/h1-5H,6H2
[InChIKey]

JTWHVBNYYWFXSI-UHFFFAOYSA-N
[SMILES]

[O-][N+](=O)CC(=O)c1ccccc1
Hazard InformationBack Directory
[Chemical Properties]

white waxy crystalline powder or flakes
[Uses]

The kinetics of proton transfer from benzoylnitromethane to various bases was studied.
[General Description]

The kinetics of proton transfer from benzoylnitromethane to various bases was studied.
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

20/21/22-36/37/38
[Safety Statements ]

26-37/39
[WGK Germany ]

3
[HS Code ]

29147000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Spectrum DetailBack Directory
[Spectrum Detail]

BENZOYLNITROMETHANE(614-21-1)1HNMR
BENZOYLNITROMETHANE(614-21-1)IR
BENZOYLNITROMETHANE(614-21-1)Raman
BENZOYLNITROMETHANE(614-21-1)FT-IR
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