ChemicalBook--->CAS DataBase List--->99-12-7

99-12-7

99-12-7 Structure

99-12-7 Structure
IdentificationMore
[Name]

Nitroxylol
[CAS]

99-12-7
[Synonyms]

1,3-DIMETHYL-5-NITROBENZENE
3,5-DIMETHYLNITROBENZENE
5-Nitro-1,3-dimethylbenzene
5-NITRO-M-XYLENE
Nitroxylol
1,3-dimethyl-5-nitro-benzen
3,5-Dimethyl-1-nitrobenzene
Benzene, 1,3-dimethyl-5-nitro-
m-Xylene, 5-nitro-
5-NITRO-M-XYLENE OEKANAL, 250 MG
5-NITRO-M-XYLENE, 99+%
1,3-Dimethyl-5-nitrobenzene=3,5-Dimethylnitrobenzene
5-NITRO-META-XYLENE
5-NITRO-M-XYLENE/1,3-DIMETHYL-5-NITROBENZENE
1-Nitro-3,5-dimethylbenzene
[EINECS(EC#)]

202-732-8
[Molecular Formula]

C8H9NO2
[MDL Number]

MFCD00007269
[Molecular Weight]

151.16
[MOL File]

99-12-7.mol
Chemical PropertiesBack Directory
[Appearance]

yellow to yellow-orange crystals or chunks
[Melting point ]

72-74 °C(lit.)
[Boiling point ]

273 °C739 mm Hg(lit.)
[density ]

1.1446 (estimate)
[refractive index ]

1.5359 (estimate)
[Fp ]

273°C
[form ]

powder to crystal
[color ]

Light orange to Yellow to Green
[Water Solubility ]

Insoluble in water.
[BRN ]

1936130
[InChI]

1S/C8H9NO2/c1-6-3-7(2)5-8(4-6)9(10)11/h3-5H,1-2H3
[InChIKey]

BYFNZOKBMZKTSC-UHFFFAOYSA-N
[SMILES]

Cc1cc(C)cc(c1)[N+]([O-])=O
[CAS DataBase Reference]

99-12-7(CAS DataBase Reference)
[NIST Chemistry Reference]

5-Nitro-m-xylene(99-12-7)
[EPA Substance Registry System]

99-12-7(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H300+H310+H330-H301-H311-H331
[Precautionary statements ]

P260-P262-P264-P270-P271-P280-P284-P301+P310+P330-P302+P352+P310+P361+P364-P304+P340+P310-P403+P233-P405-P501-P261-P280h-P301+P310a-P304+P340-P501a
[Hazard Codes ]

T,Xn
[Risk Statements ]

R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R33:Danger of cumulative effects.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S13:Keep away from food, drink and animal feeding stuffs .
[RIDADR ]

UN 3447 6.1/PG 2
[WGK Germany ]

3
[TSCA ]

Yes
[HazardClass ]

6.1
[PackingGroup ]

II
[HS Code ]

29049090
[Storage Class]

6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 3 Oral
STOT RE 2
Hazard InformationBack Directory
[General Description]

Needles or yellow crystalline solid.
[Reactivity Profile]

1,3-DIMETHYL-5-NITROBENZENE(99-12-7) is incompatible with strong oxidizing agents and strong bases.
[Air & Water Reactions]

Insoluble in water.
[Fire Hazard]

Flash point data for this compound is not available, but 1,3-DIMETHYL-5-NITROBENZENE is probably combustible.
[Chemical Properties]

yellow to yellow-orange crystals or chunks
[Uses]

5-Nitro-m-xylene was used in aerobic oxidation of aromatic anilines to aromatic azo compounds using gold nanoparticles supported on TiO2 as a catalyst.
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Nitroxylol(99-12-7).msds
Spectrum DetailBack Directory
[Spectrum Detail]

Nitroxylol(99-12-7)MS
Nitroxylol(99-12-7)1HNMR
Nitroxylol(99-12-7)13CNMR
Nitroxylol(99-12-7)IR1
Nitroxylol(99-12-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

5-Nitro-m-xylene, 99+%(99-12-7)
[Alfa Aesar]

5-Nitro-m-xylene, 99%(99-12-7)
[Sigma Aldrich]

99-12-7(sigmaaldrich)
[TCI AMERICA]

3,5-Dimethylnitrobenzene,>98.0%(GC)(99-12-7)
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