ChemicalBook--->CAS DataBase List--->99-52-5

99-52-5

99-52-5 Structure

99-52-5 Structure
IdentificationMore
[Name]

2-Methyl-4-nitroaniline
[CAS]

99-52-5
[Synonyms]

1-AMINO-2-METHYL-4-NITROBENZENE
2-AMINO-5-NITROTOLUENE
2-METHYL-4-NITROANILINE
2-METHYL-4-NITROBENZENAMINE
4-NITRO-2-METHYLANILINE
4-Nitro-2-toluidine
4-NITRO-O-TOLUIDINE
5-NITRO-2-AMINOTOLUENE
AKOS BBS-00004412
AZOIC DIAZO NO 34
CI 37100
FAST RED
FAST RED RL BASE
LABOTEST-BB LTBB000624
MNPT
ρ-Nitrotoluidine
P-NITRO-O-TOLUIDINE
PNOT
2-Amino-1-methyl-5-nitrobenzene
2-methyl-4-nitro-anilin
[EINECS(EC#)]

202-762-1
[Molecular Formula]

C7H8N2O2
[MDL Number]

MFCD00007734
[Molecular Weight]

152.15
[MOL File]

99-52-5.mol
Chemical PropertiesBack Directory
[Appearance]

Yellowneedle
[Melting point ]

130-132 °C(lit.)
[Boiling point ]

294.61°C (rough estimate)
[density ]

1.1586
[vapor pressure ]

20.4hPa at 133.5℃
[refractive index ]

1.6276 (estimate)
[Fp ]

157.2℃
[storage temp. ]

Store below +30°C.
[solubility ]

Dichloromethane, DMSO, Ethyl Acetate, Methanol
[Colour Index ]

37100
[form ]

Crystalline Powder or Fine Needles
[pka]

0.92±0.10(Predicted)
[color ]

Yellow to khaki or brownish
[PH]

7 (H2O)(aqueous suspension)
[Water Solubility ]

<0.1 g/100 mL at 22 ºC
[BRN ]

775772
[InChI]

1S/C7H8N2O2/c1-5-4-6(9(10)11)2-3-7(5)8/h2-4H,8H2,1H3
[InChIKey]

XTTIQGSLJBWVIV-UHFFFAOYSA-N
[SMILES]

Cc1cc(ccc1N)[N+]([O-])=O
[LogP]

1.311 at 25℃
[CAS DataBase Reference]

99-52-5(CAS DataBase Reference)
[NIST Chemistry Reference]

5-Nitro-2-aminotoluene(99-52-5)
[EPA Substance Registry System]

99-52-5(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)Health Hazard (GHS08)Environment (GHS09)
GHS06,GHS08,GHS09
[Signal word ]

Danger
[Hazard statements ]

H301+H311+H331-H373-H411
[Precautionary statements ]

P273-P280-P301+P310-P302+P352+P312-P304+P340+P311-P314
[Hazard Codes ]

T,N,Xi
[Risk Statements ]

R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R33:Danger of cumulative effects.
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S36/37:Wear suitable protective clothing and gloves .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 2660 6.1/PG 3
[WGK Germany ]

2
[RTECS ]

XU8210000
[Hazard Note ]

Irritant
[TSCA ]

Yes
[REACH Registrations]

Inactive
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29214300
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 3 Oral
Aquatic Chronic 2
STOT RE 2
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sodium hydroxide-->Sodium bicarbonate-->Sodium sulfite-->Methanesulfonyl chloride-->o-Toluidine-->Benzenesulfonyl chloride
[Preparation Products]

4-Bromo-2-methylbenzonitrile-->4-Fluoro-N-methylaniline-->2-Bromo-6-methyl-4-nitroaniline-->1H-Indazole-5-carbonitrile-->3,5-Dichloro (1H)indazole-->3-Chloro-1H-indazol-5-amine-->3-Iodo-5-nitro (1H)indazole-->5-Aminoindazole-->3-Chloro-5-nitro-1H-indazole-->Azoic Diazo Component 34-->2,5-Dinitrobenzoic acid-->5-Nitroindazole-->5-Bromo-2-chlorotoluene-->2-Bromo-5-nitrotoluene-->5-Bromo-2-chloro-benzoyl chloride-->2-Methyl-4-nitrophenol-->2-Methyl-6-nitroaniline-->2,7-Naphthalenedisulfonic acid, 6-amino-4-hydroxy-3-[(2-methyl-4-nitrophenyl)azo]-, disodium salt-->Disperse Blue 344
Hazard InformationBack Directory
[General Description]

Yellow needles or mustard yellow powder.
[Reactivity Profile]

2-METHYL-4-NITROANILINE(99-52-5) is incompatible with acids, acid chlorides, acid anhydrides, chloroformates and strong oxidizing agents.
[Air & Water Reactions]

Insoluble in water.
[Fire Hazard]

Flash point data for this chemical are not available; however, 2-METHYL-4-NITROANILINE is probably combustible.
[Chemical Properties]

Yellowneedle
[Uses]

2-Methyl-4-nitroaniline was used in preparing in-plane aligned nanofibers by the electrospinning technique. It was the starting reagent in the synthesis of 3-chloro-5-methylphenyl isocyanate. It was used to deposit polycrystalline thin films on Ag, Cu and Si by conventional and partially ionized beam deposition.
[Uses]

A red azoic dye.
[Production Methods]

N-Benzenesulfonyl-o-toluidine is dissolved in chlorobenzene at 40 – 50 ℃, and 62 % nitric acid is added gradually to give 5- nitro-N-benzenesulfonyl-o-toluidine, which is isolated and hydrolyzed in sulfuric acid to give 5-nitro-o-toluidine in 80 % yield.
[Purification Methods]

Crystallise the nitrotoluidine from EtOH. The acetyl and benzoyl derivatives have m 200o and 174o (EtOH) respectively. [Beilstein 12 IV 1809.]
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Amino-5-nitrotoluene (99-52-5).msds
Questions And AnswerBack Directory
[Description]

2-Methyl-4-nitroaniline was used in preparing in-plane aligned nanofibers by the electrospinning technique. It was the starting reagent in the synthesis of 3-chloro-5-methylphenyl isocyanate. It was used to deposit polycrystalline thin films on Ag, Cu and Si by conventional and partially ionized beam deposition.
[Reference]

2. Seo, Kang, and C. Bonner. "Growth of organic thin films on Si (100) surfaces: 2-Methyl-4-Nitroaniline (MNA)." APS Southeastern Section Meeting APS Southeastern Section Meeting Abstracts, 2002.
Spectrum DetailBack Directory
[Spectrum Detail]

2-Methyl-4-nitroaniline(99-52-5)MS
2-Methyl-4-nitroaniline(99-52-5)1HNMR
2-Methyl-4-nitroaniline(99-52-5)13CNMR
2-Methyl-4-nitroaniline(99-52-5)IR1
2-Methyl-4-nitroaniline(99-52-5)IR2
2-Methyl-4-nitroaniline(99-52-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Methyl-4-nitroaniline, 99%(99-52-5)
[Alfa Aesar]

2-Methyl-4-nitroaniline, 98%(99-52-5)
[Sigma Aldrich]

99-52-5(sigmaaldrich)
[TCI AMERICA]

2-Methyl-4-nitroaniline,>99.0%(GC)(99-52-5)
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