Conditions | Yield |
---|---|
With hydrogen; nickel In methanol at 65 - 75℃; for 1h; Autoclave; Inert atmosphere; | 97% |
With aluminum oxide; hydrazine hydrate; iron(III) chloride at 111℃; for 0.1h; Irradiation; microwave; | 96% |
With hydrazine hydrate In ethanol at 70℃; for 4h; chemoselective reaction; | 94% |
Conditions | Yield |
---|---|
With 5%-palladium/activated carbon; hydrogen In ethanol at 20℃; for 48h; | 96.6% |
With hydrogen In methanol at 50℃; under 1500.15 Torr; for 0.25h; Inert atmosphere; | 88% |
With 5 wt% ruthenium/carbon; hydrogen; sodium nitrite In isopropyl alcohol at 150℃; under 62256.2 Torr; for 4h; Temperature; Autoclave; |
Conditions | Yield |
---|---|
With methanol; samarium diiodide In tetrahydrofuran at 20℃; for 0.333333h; | 91% |
With magnesium In methanol at 45 - 60℃; for 1.83333h; | 86% |
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With formic acid; zinc In methanol at 20℃; for 24h; Inert atmosphere; | 90% |
Conditions | Yield |
---|---|
With tetrahydroxydiboron; water at 80℃; for 8h; | 86% |
With tetrahydroxydiboron; 5%-palladium/activated carbon; water In acetonitrile at 50℃; for 24h; | 80% |
With hydrogenchloride; tin |
5-methylbenzofuroxan
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With ammonium sulfate; magnesium In methanol Ambient temperature; | 80% |
With Saccharomyces cerevisiae BY In methanol at 20℃; for 6.5h; pH=7.0; aq. buffer; Enzymatic reaction; | 80% |
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With formic acid; zinc In methanol at 20℃; for 10h; Inert atmosphere; | 76% |
2-amino-4-methylacetanilide
A
2,5-dimethylbenzimidazole
B
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
Erhitzen; |
(4-amino-3-nitrophenyl)methanol
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With hydrogenchloride; tin |
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With hydrogenchloride; tin |
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With hydrogenchloride; tin |
Conditions | Yield |
---|---|
bei reduktiver Spaltung; |
4-methyl-2-p-tolylazo-aniline
A
p-toluidine
B
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
durch Reduktionsmittel; |
4-methyl-2-p-tolylazo-aniline
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
bei der Reduktion; |
4,4'-dimethyl-2-nitro-ONN-azoxybenzene
A
p-toluidine
B
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With hydrogenchloride; acetic acid; tin(ll) chloride for 2h; Title compound not separated from byproducts; |
4,4'-dimethyl-2,3'-dinitro-ONN-azoxybenzene
A
4-methylbenzene-1,3-diamine
B
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With hydrogenchloride; acetic acid; tin(ll) chloride for 3h; Title compound not separated from byproducts; |
hydrogenchloride
5-Methyl-benzo[1,2,5]selenadiazole
A
4-methyl-1,2-diaminobenzene
hydrogenchloride
5-Methyl-benzo[1,2,5]selenadiazole
A
4-methyl-1,2-diaminobenzene
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With hydrogenchloride; tin |
ethanol
acetic acid
2-(2-(4-methyl-2-nitrophenyl)hydrazono)-3-oxo-N-phenylbutanamide
A
4-methyl-1,2-diaminobenzene
4-methyl-2-p-tolylazo-aniline
A
p-toluidine
B
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
at 300℃; |
hydrogenchloride
(4-methyl-2-nitro-phenylhydrazono)-phenyl-acetonitrile
A
hydrogen cyanide
B
4-methyl-1,2-diaminobenzene
C
benzoic acid
hydrogenchloride
3,4-Dinitrotoluene
A
5-methyl-2-nitroaniline
B
4-methyl-1,2-diaminobenzene
C
4-methyl-2-nitroaniline
Conditions | Yield |
---|---|
at 7℃; |
hydrogenchloride
(4-amino-3-nitrophenyl)methanol
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
durch laengeres Behandeln; |
hydrogenchloride
ethanol
trichloro-acetic acid-(4-methyl-2-nitro-anilide)
4-methyl-1,2-diaminobenzene
glycolic Acid
4-methyl-1,2-diaminobenzene
(5-methyl-1H-benzimidazole-2-yl)methanol
Conditions | Yield |
---|---|
With hydrogenchloride In water for 3h; Reflux; | 100% |
With hydrogenchloride In water for 6h; Reflux; | 83% |
With phosphoric acid at 130℃; for 3h; | 72% |
Conditions | Yield |
---|---|
at 100℃; for 0.25h; | 100% |
With gallium(III) triflate In ethanol at 20℃; for 0.0833333h; | 100% |
With aluminum oxide at 20℃; for 0.166667h; neat (no solvent); | 100% |
Conditions | Yield |
---|---|
With zirconium(IV) chloride In methanol at 20℃; for 0.0833333h; | 100% |
With silica-supported stannous chloride In methanol at 20℃; for 0.0333333h; | 99% |
With zirconium oxide salicylaldehyde-(3-aminopropyl)trimethoxysilane imine complex modified SBA-15 In water for 0.1h; Reflux; | 99% |
Conditions | Yield |
---|---|
at 80℃; for 1h; solid-state reaction; | 100% |
With zirconium(IV) chloride In methanol at 20℃; for 0.5h; | 100% |
With aluminum oxide at 20℃; for 0.166667h; neat (no solvent); | 99% |
Conditions | Yield |
---|---|
With gallium(III) triflate In ethanol at 20℃; for 0.166667h; | 100% |
With amberlyst-15 In water at 70℃; for 0.183333h; | 99% |
With aluminum oxide at 20℃; for 0.166667h; neat (no solvent); | 99% |
4-methyl-1,2-diaminobenzene
orthoformic acid triethyl ester
6-methyl-1H-benzo[d]imidazole
Conditions | Yield |
---|---|
With zirconium(IV) chloride In methanol at 20℃; for 3h; | 100% |
With sulfonated rice husk ash In neat (no solvent) at 60℃; for 0.116667h; | 95% |
With nano-Ni(II)/Y zeolite catalyst In neat (no solvent) at 60℃; for 1.33333h; Green chemistry; | 83% |
With silica tungstic acid at 80℃; for 0.2h; Neat (no solvent); | 80% |
With iron oxide In neat (no solvent) at 80℃; for 0.6h; Green chemistry; | 77% |
Conditions | Yield |
---|---|
In dichloromethane at -10 - 20℃; Overall yield = 88 %; | A 100% B n/a |
Conditions | Yield |
---|---|
In ethanol at 80℃; for 8h; Inert atmosphere; | 100% |
Conditions | Yield |
---|---|
With [P4-VP]-PdNPs In N,N-dimethyl-formamide at 120℃; for 0.0133333h; Reflux; | 99% |
With morpholine; iron(III) chloride In ethanol at 80℃; for 1.5h; | 94% |
With 5% ruthenium on carbon; oxygen In water at 75℃; for 24h; | 89% |
4-methyl-1,2-diaminobenzene
1,1'-carbonyldiimidazole
5-methyl-1,3-dihydro-2H-benzimidazol-2-one
Conditions | Yield |
---|---|
In N,N-dimethyl-formamide at 20℃; for 15h; | 99% |
In tetrahydrofuran; dichloromethane at 20℃; for 8h; | 89% |
In tetrahydrofuran at 20℃; | 82% |
Conditions | Yield |
---|---|
In water at 30℃; for 0.00972222h; Irradiation; Sonication; Green chemistry; | 99% |
With bismuth(lll) trifluoromethanesulfonate In water at 20℃; for 0.1h; | 91% |
In ethanol for 2h; Heating; |
4-nitrobenzaldehdye
4-methyl-1,2-diaminobenzene
5‐methyl‐2‐(4‐nitrophenyl)‐1H‐benzo[d]imidazole
Conditions | Yield |
---|---|
With hydrogenchloride; dihydrogen peroxide In acetonitrile at 20℃; for 0.833333h; | 99% |
With silica-bound phosphoric acid In water at 70℃; for 0.00416667h; | 95% |
With oxygen In water; acetonitrile at 20℃; under 760.051 Torr; for 24h; Sealed tube; Green chemistry; | 94% |
1,10-phenanthroline-5,6-dione
4-methyl-1,2-diaminobenzene
7-methyldipyrido[3,2-a:2’,3’-c]phenazine
Conditions | Yield |
---|---|
With sulfated titania (TiO2-SO42-) In ethanol at 20℃; for 0.133333h; | 99% |
With sulfated TiO2-P25 (Degussa titania) for 0.0333333h; Microwave irradiation; Neat (no solvent); | 99% |
With sulfate loaded TiO2 for 0.0333333h; Microwave irradiation; Neat (no solvent); | 99% |
Conditions | Yield |
---|---|
With iodine In acetonitrile at 25℃; for 0.0333333h; | 99% |
at 26 - 30℃; for 3.5h; Ionic liquid; | 95% |
With salicylic acid at 20℃; for 1h; | 92% |
Triethyl orthoacetate
4-methyl-1,2-diaminobenzene
2,5-dimethylbenzimidazole
Conditions | Yield |
---|---|
With nano-Ni(II)/Y zeolite catalyst In neat (no solvent) at 60℃; for 0.766667h; Green chemistry; | 99% |
With [PVP-SO3H] HSO4 at 60℃; for 0.0666667h; | 96% |
With ammonium chloride In water Inert atmosphere; Reflux; Green chemistry; | 95% |
2-chloro-benzaldehyde
4-methyl-1,2-diaminobenzene
2-(2-chloro-phenyl)-5-methyl-1(3)H-benzoimidazole
Conditions | Yield |
---|---|
With hydrogenchloride; dihydrogen peroxide In acetonitrile at 20℃; for 0.666667h; | 99% |
With air In 1,4-dioxane at 100℃; for 20h; | 90% |
With methanesulfonic acid; silica gel In neat (no solvent) at 90℃; for 6h; Green chemistry; | 82% |
With TCCA In 1,4-dioxane; acetonitrile at 20℃; for 1.83333h; | 80% |
1,2-di(4-methylphenyl)-1,2-ethanedione
4-methyl-1,2-diaminobenzene
6-methyl-2,3-di-p-tolylquinoxaline
Conditions | Yield |
---|---|
With Cs(cetyltrimethylammonium)2PW12O40 In neat (no solvent) at 80℃; for 0.166667h; Green chemistry; | 99% |
With zirconium tetrakis(dodecyl sulfate) In water at 20℃; for 0.583333h; | 95% |
at 120℃; for 0.0666667h; Microwave irradiation; | 95% |
Conditions | Yield |
---|---|
With sodium metabisulfite; air In N,N-dimethyl-formamide at 90℃; for 2h; | 99% |
With sodium metabisulfite In ethanol; water at 20℃; for 2h; | 89% |
With sodium disulfite for 0.0133333h; microwave irradiation; | 85% |
With sodium metabisulfite In N,N-dimethyl-formamide at 100℃; for 42h; | 69% |
di-tert-butyl dicarbonate
4-methyl-1,2-diaminobenzene
N, N'-di-(tert-butoxycarbonyl)-3,4-diaminotoluene
Conditions | Yield |
---|---|
With iron oxide In ethanol at 20℃; for 0.75h; Green chemistry; chemoselective reaction; | 99% |
With guanidine hydrochloride In ethanol at 35 - 40℃; for 0.333333h; | 94% |
With [H2-cryptand 222](Br3)2 In acetonitrile at 20℃; for 8h; chemoselective reaction; | 70% |
Stage #1: di-tert-butyl dicarbonate With C12H24KO6(1+)*Br3H(1-) In ethanol at 20℃; for 0.0166667h; Stage #2: 4-methyl-1,2-diaminobenzene In ethanol at 20℃; for 4.25h; | 65% |
carbon dioxide
4-methyl-1,2-diaminobenzene
5-methyl-1,3-dihydro-2H-benzimidazol-2-one
Conditions | Yield |
---|---|
With tetrabutylammonium tungstate In 1-methyl-pyrrolidin-2-one at 139.84℃; under 15001.5 Torr; for 24h; Autoclave; | 99% |
In tetrahydrofuran; water at 20℃; under 7500.75 Torr; for 9h; UV-irradiation; | 99% |
With Sn(IV)-doped DFNS supported CdSnO3 nanoparticles under 11251.1 Torr; for 1h; UV-irradiation; | 98% |
4-methyl-1,2-diaminobenzene
benzyl alcohol
5-methyl-2-phenyl-1H-1,3-benzimidazole
Conditions | Yield |
---|---|
With C19H35Cl2CoN2P; sodium triethylborohydride In toluene at 150℃; for 24h; Molecular sieve; Schlenk technique; | 99% |
With trans-bis(quinoline-2-carboxylato)bis(ethanol)cobalt(II); sodium carbonate In acetonitrile at 20℃; for 2h; | 90% |
With C56H86Cl3IrN2P2Ru Schlenk technique; Inert atmosphere; | 89% |
2-Formylphenoxyacetic acid
4-methyl-1,2-diaminobenzene
2-CHLOROBENZYLAMINE
Conditions | Yield |
---|---|
With natural silk-supported manganese(II) tetrasulfophthalocyanine In water at 20℃; for 8h; Green chemistry; | 99% |
4-Methylbenzyl alcohol
4-methyl-1,2-diaminobenzene
5-methyl-2-(4-methylphenyl)-1H-benzimidazole
Conditions | Yield |
---|---|
With C19H35Cl2CoN2P; sodium triethylborohydride In toluene at 150℃; for 24h; Molecular sieve; Schlenk technique; | 99% |
Stage #1: 4-Methylbenzyl alcohol With N-hydroxyphthalimide; Mo72V30; oxygen In ethyl acetate at 70℃; for 6.5h; Stage #2: 4-methyl-1,2-diaminobenzene In ethyl acetate | 87% |
With N-hydroxyphthalimide at 70℃; for 3h; | 79% |
With C13H16MnN2O3S(1+)*Br(1-); potassium hydroxide In neat (no solvent) at 140℃; for 20h; | 74% |
Conditions | Yield |
---|---|
With C19H35Cl2CoN2P; sodium triethylborohydride In toluene at 150℃; for 24h; Molecular sieve; Schlenk technique; | 99% |
With 1,10-Phenanthroline; potassium tert-butylate; nickel dichloride In toluene at 140℃; for 24h; Schlenk technique; Inert atmosphere; Sealed tube; | 45% |
1,2-di(thiophen-2-yl)ethyne
4-methyl-1,2-diaminobenzene
Conditions | Yield |
---|---|
With dimethyl sulfoxide at 140℃; for 3.5h; Sealed tube; | 99% |
Conditions | Yield |
---|---|
With polyamine dendrimer with glycerol initiated polyepichlorohydrin; air In ethanol at 20℃; for 0.0333333h; | 99% |
benzaldehyde
4-methyl-1,2-diaminobenzene
5-methyl-2-phenyl-1H-1,3-benzimidazole
Conditions | Yield |
---|---|
With hydrogenchloride; dihydrogen peroxide In acetonitrile at 20℃; for 0.666667h; | 98% |
With sodium hydrogensulfite In N,N-dimethyl acetamide at 100℃; for 2h; | 98.9% |
With ammonium peroxydisulfate; sodium dodecyl-sulfate In water at 25℃; for 0.3h; Micellar solution; | 98% |
Conditions | Yield |
---|---|
With Co3O4 nanoparticles at 20℃; for 0.2h; Green chemistry; | 98% |
In water at 50℃; for 0.133333h; | 91% |
Conditions | Yield |
---|---|
With 10 wtpercent sulfated polyborate In neat (no solvent) at 100℃; for 0.05h; Green chemistry; | 98% |
With Polystyrene-Supported AlCl3 In ethanol for 0.2h; Reflux; | 94% |
With potassium fluoride on basic alumina at 20℃; for 1h; | 92% |
4-methyl-1,2-diaminobenzene
9,10-phenanthrenequinone
11-methyl-dibenzo[a,c]phenazine
Conditions | Yield |
---|---|
With calcium hydrogensulfate In ethanol at 20℃; for 0.0833333h; | 98% |
With N,N,N’,N’-tetrabromobenzene-1,3-disulfonamide In neat (no solvent) at 80℃; for 0.133333h; | 97% |
With 1-(propyl-3-sulfonate) 3-methylimidazol(3H)-1-ium phosphotungstate In water at 20℃; for 0.166667h; Reagent/catalyst; Time; | 97% |
Reported in EPA TSCA Inventory.
3,4-Diaminotoluene(CAS NO.496-72-0), its Synonyms are o-Tolamine; Tolamine-3.4; Toluene-3.4-diamine;
1.2-Diamino-4-methylbenzene; 3.4-Diamino-1-methylbenzene; 4-Methyl-1.2-benzenediamine; Methylorthamine; 3-Methylorthamine; 4-Methyl-o-phenylenediamine; o-Toluylenediamine; 3.4-Toluylenediamine. It is off-white small blocks. It is used in the synthesis of colorlant compounds (dyestuffs, pigments, optical brighteners and hair dyes), pesticides, corrosion inhibitors and antioxidants.
Physical properties about 3,4-Diaminotoluene are: (1)ACD/LogP: 0.508; (2)ACD/LogD (pH 5.5): 0.43; (3)ACD/LogD (pH 7.4): 0.51; (4)ACD/BCF (pH 5.5): 1.21; (5)ACD/BCF (pH 7.4): 1.43; (6)ACD/KOC (pH 5.5): 37.99; (7)ACD/KOC (pH 7.4): 44.90; (8)#H bond acceptors: 2; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.636; (12)Molar Refractivity: 39.55 cm3; (13)Molar Volume: 110.269 cm3; (14)Polarizability: 15.679 10-24cm3; (15)Surface Tension: 52.3349990844727 dyne/cm; (16)Density: 1.108 g/cm3; (17)Flash Point: 132.104 °C; (18)Enthalpy of Vaporization: 50.005 kJ/mol; (19)Boiling Point: 262.278 °C at 760 mmHg; (20)Vapour Pressure: 0.0109999999403954 mmHg at 25°C
When you are using this chemical, please be cautious about it as the following:
1. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice;
2. Wear suitable protective clothing and gloves;
3. Avoid release to the environment. Refer to special instructions safety data sheet;
4. Wear suitable protective clothing, gloves and eye/face protection;
You can still convert the following datas into molecular structure:
(1)InChI=1S/C7H10N2/c1-5-2-3-6(8)7(9)4-5/h2-4H,8-9H2,1H3;
(2)InChIKey=DGRGLKZMKWPMOH-UHFFFAOYSA-N;
(3)Smilesc1(c(ccc(c1)C)N)N;
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rabbit | LDLo | subcutaneous | 100mg/kg (100mg/kg) | Zeitschrift fuer Experimentelle Pathologie und Therapie. Vol. 17, Pg. 59, 1915. |
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