3-Methyl-2-nitroaniline supplier

Name
3-Methyl-2-nitroaniline
EINECS
CAS No. 601-87-6
Article Data24
CAS DataBase
Density 1.27 g/cm³
Solubility
Melting Point 107-108 °C
Formula C₇H₈N₂O₂
Boiling Point 288.553 °C at 760 mmHg
Molecular Weight 152.153
Flash Point 128.313 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms m-Toluidine,2-nitro- (6CI);2-Nitro-3-methylaniline;3-Amino-2-nitrotoluene;3-Methyl-2-nitroaniline;
PSA 71.84000
LogP 2.58980

Synthetic route

: 60310-07-8
3-Methyl-2-nitrobenzenecarboxamide

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
With bromine; sodium hydroxide In water at 0 - 80℃; for 2h;	90%
With bromine; sodium hydroxide In water at 0 - 80℃; for 2h;	90%
With bromine; sodium hydroxide In water at 0 - 80℃; for 2h;	90%

: 27808-46-4
4-methyl-benzofuroxan

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
With iron(II) sulfate In water; dimethyl sulfoxide for 48h; Ambient temperature;	90%
With HbO2(2+) In phosphate buffer; dimethyl sulfoxide for 1h; pH=7.4;	100 % Chromat.

: 602-01-7
1-methyl-2,3-dinitrobenzene

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
With hydrogenchloride; ethanol; tin(ll) chloride at 7℃;
With tin(ll) chloride

: 5367-26-0
3-chloro-2-nitrotoluene

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
With ammonia at 200℃; im Rohr;

: 5437-38-7
3-methyl-2-nitrobenzoic acid

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
With sodium azide; sulfuric acid
Multi-step reaction with 3 steps 3: Br2, KOH View Scheme
Multi-step reaction with 3 steps 1: PCl5 2: HCO2NH4 3: Br2, aq. KOH View Scheme

: 7664-93-9
sulfuric acid

: 108-44-1
1-amino-3-methylbenzene

HNO3+H2SO4: HNO3+H2SO4

A: 611-05-2
4-nitro-3-methylaniline

B: 601-87-6
3-methyl-2-nitroaniline

C: 578-46-1
5-methyl-2-nitroaniline

Conditions

Conditions	Yield
Nitrieren;

...Expand

: 602-01-7
1-methyl-2,3-dinitrobenzene

ammonium sulfide: ammonium sulfide

: 601-87-6
3-methyl-2-nitroaniline

: 7647-01-0
hydrogenchloride

: 602-01-7
1-methyl-2,3-dinitrobenzene

tin (II)-chloride: tin (II)-chloride

: 601-87-6
3-methyl-2-nitroaniline

...Expand

: 5367-26-0
3-chloro-2-nitrotoluene

: 7664-41-7
ammonia

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
at 200℃;

: 50424-93-6
3-methyl-2-nitrobenzoyl chloride

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 2: Br2, KOH View Scheme
Multi-step reaction with 2 steps 1: benzene 2: aqueous potassium hypobromite View Scheme
Multi-step reaction with 2 steps 1: HCO2NH4 2: Br2, aq. KOH View Scheme

: 2719-14-4
4-acetylamino-2-nitrotoluene

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: (i) HNO3, (ii) H2SO4, EtOH 2: (deamination) 3: SnCl2 View Scheme

: 70343-09-8
2,3-dinitro-4-methylaniline

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: (deamination) 2: SnCl2 View Scheme

: 99-04-7
m-Toluic acid

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: HNO3 2: PCl5 3: HCO2NH4 4: Br2, aq. KOH View Scheme

: 3013-27-2
1-fluoro-3-methyl-2-nitro-benzene

: 601-87-6
3-methyl-2-nitroaniline

Conditions

Conditions	Yield
With ammonium hydroxide In ethanol; water at 0 - 80℃; for 24h; Sealed tube;

: 601-87-6
3-methyl-2-nitroaniline

: 157284-01-0
3-amino-8-methyl-1,2,4-benzotriazine 1-oxide

Conditions

Conditions	Yield
	100%
Multi-step reaction with 2 steps 1: HCl / 100 °C 2: 100 percent / aq. NaOH / 1 h / 100 °C View Scheme

: 601-87-6
3-methyl-2-nitroaniline

: 2687-25-4
3-methyl-1,2-benzenediamine

Conditions

Conditions	Yield
With palladium 10% on activated carbon; ammonium formate In methanol at 70℃; for 3h;	98%
With tin(II) chloride dihdyrate In ethyl acetate at 20℃;	62%
durch Reduktion;
With hydrogen In methanol at 20℃; under 1551.49 Torr; for 2h;
With palladium 10% on activated carbon; hydrogen In methanol at 20℃; for 2h; High pressure;

: 601-87-6
3-methyl-2-nitroaniline

: 100-52-7
benzaldehyde

: 3659-77-6
4-methyl-2-phenyl-1H-benzimidazole

Conditions

Conditions	Yield
With hydrogen In ethyl acetate at 60℃; under 7500.75 Torr; for 20h; Autoclave; Green chemistry;	97%
With hydrogen In ethyl acetate at 60℃; under 7500.75 Torr; for 20h; Autoclave;	97%

: 601-87-6
3-methyl-2-nitroaniline

: 3523-86-2
4-methylbenzofurazan oxide

Conditions

Conditions	Yield
With sodium hydroxide; sodium hypochlorite In ethanol at 25℃; for 0.0833333h;	96%

: 601-87-6
3-methyl-2-nitroaniline

: 879-18-5
naphthalene-1-carbonic acid chloride

: 199594-51-9
N-(1-naphthoyl)-2-methyl-2-nitroanilide

Conditions

Conditions	Yield
for 7h;	91%

: 601-87-6
3-methyl-2-nitroaniline

: 513-85-9
2.3-butanediol

: 17635-19-7
5-methyl-2,3-dimethylquinoxaline

Conditions

Conditions	Yield
With sodium hydroxide In toluene at 120℃; for 3h; Inert atmosphere; Sealed tube; Green chemistry;	90%

: 601-87-6
3-methyl-2-nitroaniline

: 52414-99-0
1-iodo-3-methyl-2-nitrobenzene

Conditions

Conditions	Yield
Stage #1: 3-methyl-2-nitroaniline With sulfuric acid; sodium nitrite In water cooling; Stage #2: With copper; potassium iodide In water at 80℃; for 0.5h;	88%
Diazotieren und Behandeln mit Kaliumjodid Loesung;

: 696-59-3
cis,trans-2,5-dimethoxytetrahydrofuran

: 601-87-6
3-methyl-2-nitroaniline

: 1224955-41-2
C11H10N2O2

Conditions

Conditions	Yield
With acetic acid at 120℃; for 1h; Inert atmosphere;	87%
With acetic acid for 1h; Reflux;	87%

: 601-87-6
3-methyl-2-nitroaniline

: 108-24-7
acetic anhydride

: 90868-29-4
N-(3-methyl-2-nitrophenyl)acetamide

Conditions

Conditions	Yield
With sulfuric acid In acetic acid at 90℃; for 0.666667h;	85%
With sulfuric acid

: 601-87-6
3-methyl-2-nitroaniline

: 6-bromo-3-methyl-2-nitroaniline

Conditions

Conditions	Yield
With N-Bromosuccinimide; acetic acid at 120℃; for 4h;	80%

: 601-87-6
3-methyl-2-nitroaniline

: 854624-54-7
4-bromo-3-methyl-2-nitro-aniline

Conditions

Conditions	Yield
With N-Bromosuccinimide; acetic acid at 110℃; for 1h;	78%
With N-Bromosuccinimide; acetic acid at 110℃; for 1h;	78%
With N-Bromosuccinimide; acetic acid at 110℃; for 1h;	78%

: 601-87-6
3-methyl-2-nitroaniline

: 2243-83-6
2-naphthaloyl chloride

: 199594-52-0
N-(2-naphthoyl)-2-methyl-2-nitroanilide

Conditions

Conditions	Yield
for 7h;	75%

: 201230-82-2
carbon monoxide

: 601-87-6
3-methyl-2-nitroaniline

: 19190-68-2
4-methyl-1,3-dihydro-2H-benzoimidazol-2-one

Conditions

Conditions	Yield
With selenium; 1,8-diazabicyclo[5.4.0]undec-7-ene; triethylamine In toluene at 150℃; under 22800 Torr; for 4h;	71%

: 601-87-6
3-methyl-2-nitroaniline

: 75-07-0
acetaldehyde

: 160984-53-2
3-(N-Ethylamino)-2-nitrotoluene

Conditions

Conditions	Yield
With sodium cyanoborohydride; acetic acid In methanol for 15h; Ambient temperature;	65%

: 601-87-6
3-methyl-2-nitroaniline

: benzene 1,3,5-triyl triformate

: 19190-68-2
4-methyl-1,3-dihydro-2H-benzoimidazol-2-one

Conditions

Conditions	Yield
With selenium; triethylamine In N,N-dimethyl-formamide at 120℃; Inert atmosphere; Sealed tube;	62%

: 601-87-6
3-methyl-2-nitroaniline

: 71-43-2
benzene

: 82617-45-6
3-methyl-2-nitro-[1,1 '-biphenyl]

Conditions

Conditions	Yield
With hydrogenchloride; potassium acetate; sodium nitrite 1.) 0 deg C, 2.) 5-10 deg C, 4 h, 3.) RT, 24 h;	61%

: 931-17-9
1,2-Cyclohexanediol

: 601-87-6
3-methyl-2-nitroaniline

: 6-methyl-1,2,3,4-tetrahydrophenazine

Conditions

Conditions	Yield
With potassium phosphate monohydrate; trimethylamine-N-oxide; C18H27FeO4Si2 In toluene at 150℃; for 48h; Inert atmosphere; Schlenk technique; Sealed tube;	61%

: 601-87-6
3-methyl-2-nitroaniline

: 52414-97-8
1-bromo-3-methyl-2-nitro-benzene

Conditions

Conditions	Yield
With tert.-butylnitrite; copper(ll) bromide In acetonitrile at 65℃; for 0.25h; Heating / reflux;	57%
With hydrogen bromide Diazotization.Behandlung der Diazoniumsalz-Loesung mit CuBr;

: 540-80-7
tert.-butylnitrite

: 601-87-6
3-methyl-2-nitroaniline

: 52414-97-8
1-bromo-3-methyl-2-nitro-benzene

Conditions

Conditions	Yield
With copper(I) bromide In acetonitrile at 65℃; for 0.25h; Heating / reflux;	57%

: 601-87-6
3-methyl-2-nitroaniline

: 20260-53-1
pyridine-3-carbonyl chloride hydrochloride

: 212503-75-8
N-nicotinoyl-2-methyl-6-nitroanilide

Conditions

Conditions	Yield
	55%

: 601-87-6
3-methyl-2-nitroaniline

: 18063-02-0
2,6-difluorobenzoylchloride

: 212503-70-3
N-(2,6-difluorobenzoyl)-2-methyl-6-nitroaniline

Conditions

Conditions	Yield
	55%

: 601-87-6
3-methyl-2-nitroaniline

: 39178-35-3
isonicotinoyl chloride hydrochloride

: 212503-71-4
N-isonicotinoyl-2-methyl-6-nitroanilide

Conditions

Conditions	Yield
for 4h;	53%

: 601-87-6
3-methyl-2-nitroaniline

: 5-(1-(3,5-dichloropyridin-4-yl)ethoxy)-1H-indazole-3-carbaldehyde

: 5-(1-(3,5-dichloropyridin-4-yl)ethoxy)-3-(4-methyl-1H-benzo[d]-imidazol-2-yl)-1H-indazole

Conditions

Conditions	Yield
Stage #1: 3-methyl-2-nitroaniline With palladium 10% on activated carbon; hydrogen In methanol at 20℃; for 2h; Stage #2: 5-(1-(3,5-dichloropyridin-4-yl)ethoxy)-1H-indazole-3-carbaldehyde With sulfur In N,N-dimethyl-formamide at 90℃; for 2h; Inert atmosphere;	51%

: 108-86-1
bromobenzene

: 601-87-6
3-methyl-2-nitroaniline

: 220495-97-6
3-methyl-2-nitrodiphenylamine

Conditions

Conditions	Yield
With copper(l) iodide; potassium carbonate for 16h; Heating;	45%

: 601-87-6
3-methyl-2-nitroaniline

: 78-84-2
isobutyraldehyde

: 3-methyl-2-nitro-N-(2-methyl-1-propen-1-yl)benzenamine

Conditions

Conditions	Yield
With 4 A molecular sieve In benzene at 20℃; for 72h;	36%

: 50-00-0
formaldehyd

: 601-87-6
3-methyl-2-nitroaniline

: 70254-75-0
3-methyl-2-nitro-N-methylaniline

Conditions

Conditions	Yield
With sulfuric acid for 1h;	29%

: 4654-39-1
4-bromophenethanol

: 601-87-6
3-methyl-2-nitroaniline

: 2-[4-(3-methyl-2-nitroanilino)phenyl]ethanol

Conditions

Conditions	Yield
With copper(l) iodide; potassium carbonate at 200℃; for 2h; in a sealed tube;	21%
With CuI; potassium carbonate	700 mg (21%)

: 85-44-9
phthalic anhydride

: 601-87-6
3-methyl-2-nitroaniline

: 2-(3-Methyl-2-nitro-phenyl)-isoindole-1,3-dione

Conditions

Conditions	Yield
In pentan-1-ol for 12h; Heating;	15%

3-Methyl-2-nitroaniline Specification

The 3-Methyl-2-nitroaniline with the CAS number 601-87-6 is also called Benzenamine,3-methyl-2-nitro-. Its molecular formula is C₇H₈N₂O₂. The product category is Aromatic Hydrocarbons (substituted) & Derivatives. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 3-Methyl-2-nitroaniline are: (1)ACD/LogP: 2.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.009; (4)ACD/LogD (pH 7.4): 2.009; (5)ACD/BCF (pH 5.5): 19.822; (6)ACD/BCF (pH 7.4): 19.822; (7)ACD/KOC (pH 5.5): 295.196; (8)ACD/KOC (pH 7.4): 295.196; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 71.84 Å²; (13)Index of Refraction: 1.616; (14)Molar Refractivity: 41.859 cm³; (15)Molar Volume: 119.83 cm³; (16)Polarizability: 16.594×10^-24cm³; (17)Surface Tension: 54.936 dyne/cm; (18)Enthalpy of Vaporization: 52.78 kJ/mol; (19)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cccc(c1N(=O)=O)N
(2)InChI: InChI=1/C7H8N2O2/c1-5-3-2-4-6(8)7(5)9(10)11/h2-4H,8H2,1H3
(3)InChIKey: VDCZKCIEXGXCDJ-UHFFFAOYAM

Product Name

3-Methyl-2-nitroaniline

Synthetic route

3-Methyl-2-nitroaniline Specification

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