Conditions | Yield |
---|---|
With alumina supported titanium dioxide-bismuth oxide metal oxide catalyst at 120℃; for 8h; Sealed tube; | 99.41% |
Stage #1: methanol; urea at 30℃; for 20h; Autoclave; Stage #2: With carbon dioxide; 6O4P(3-)*5Ni(2+)*5Ca(2+)*2F(1-) at 160℃; under 4500.45 Torr; for 6h; Temperature; Concentration; | 98.9% |
With silica supported titanium dioxide at 160℃; under 17251.7 Torr; for 8h; Temperature; Pressure; Inert atmosphere; | 98% |
Conditions | Yield |
---|---|
With Na-ZnO-ZrO2 / γ-Al2O3 at 180℃; for 6h; Temperature; Reagent/catalyst; Autoclave; | 98.8% |
Conditions | Yield |
---|---|
With ammonia In diethyl ether for 0.0833333h; | A 78% B 92% |
methanol
1,2-bis(1-isocyanato-1-methylethyl)diazene
A
5,5-dimethyl-Δ1-1,2,4-triazolin-3-one
B
methyl carbamate
Conditions | Yield |
---|---|
for 2h; Product distribution; Mechanism; Heating; other alcohols; var. reaction time; var. temperatures; | A 90% B n/a C n/a D n/a |
for 2h; Heating; Yield given. Yields of byproduct given; |
Conditions | Yield |
---|---|
With ammonia In ethanol at 18 - 25℃; for 24h; | A n/a B 90% |
Conditions | Yield |
---|---|
at 179.84℃; for 10h; | A 84.8% B 6.5% |
With zinc/aluminum mixed oxide at 179.84℃; for 10h; Reagent/catalyst; Autoclave; | A 55.1% B 36.5% |
calcined La(NO3)3x6H2O at 170℃; under 14821 Torr; for 4h; Product distribution / selectivity; Autoclave; Inert atmosphere; | A 41.2% B 53.4% |
With Zn/Ca-catalyst at 179.84℃; for 10h; | A 50.5% B 41.2% |
With Ga2O3/CeO2-Al2O3 at 110℃; for 5h; |
Conditions | Yield |
---|---|
With para-dodecylbenzenesulfonic acid In neat (no solvent) at 60℃; for 0.5h; Green chemistry; | 80% |
With DBSA at 60℃; for 1h; |
Conditions | Yield |
---|---|
With triethylamine In methanol; dichloromethane; ethyl acetate | 78% |
With ammonia; benzene | |
With potassium hydrogencarbonate In water |
methanol
2,4-dioxo-6-methyl-3,4-dihydro-2H-1,3-oxazine
A
acetoacetic acid methyl ester
B
methyl carbamate
Conditions | Yield |
---|---|
With triethylamine for 24h; Heating; | A 70% B 15% |
3-cyano-2-amino-4,5,6,7-tetrahydrobenzo[b]thiophene
methyl chloroformate
methyl carbamate
Conditions | Yield |
---|---|
With sodium hydrogencarbonate In butanone | 66% |
methanol
urea
A
methyl N-methylcarbamate
B
methyl carbamate
C
carbonic acid dimethyl ester
Conditions | Yield |
---|---|
With ZnO-SrO at 170℃; for 6h; Reagent/catalyst; Temperature; Time; | A 17% B 55% C 28% |
With MgZn1.7Al hydrotalcite calcined at 450°C at 200℃; under 15001.5 Torr; for 4h; Catalytic behavior; Time; Autoclave; | A 14% B 28% C 28% |
(2E)-2,3-Diisopropyl-azimin-1-carbonsaeure-methylester
A
N-(1-Aethoxyaethyl)carbaminsaeure-methylester
B
methyl carbamate
Conditions | Yield |
---|---|
In diethyl ether at 12℃; Irradiation; Yield given. Further byproducts given. Yields of byproduct given. Title compound not separated from byproducts; | A 7% B n/a C 31% D n/a |
In diethyl ether at 12℃; Irradiation; Yield given. Further byproducts given. Title compound not separated from byproducts; | A 5% B n/a C 18% D n/a |
In diethyl ether at 12℃; Irradiation; Further byproducts given; | A 5% B n/a C 18% D n/a |
In diethyl ether at 12℃; Irradiation; Further byproducts given. Yields of byproduct given; | A 5% B n/a C 18% D n/a |
In diethyl ether at 12℃; Irradiation; Yield given. Further byproducts given; | A 5% B n/a C 18% D n/a |
(2E)-2,3-Diisopropyl-azimin-1-carbonsaeure-methylester
A
methyl carbamate
Conditions | Yield |
---|---|
In diethyl ether at 12℃; Irradiation; Yield given. Further byproducts given; | A n/a B n/a C 18% D n/a |
methanol
diethyl ether
cyanic acid
A
allophanic acid methyl ester
B
methyl carbamate
methanol
cyanic acid
A
allophanic acid methyl ester
B
methyl carbamate
Conditions | Yield |
---|---|
With hydrogen sulfide | |
With hydrogenchloride |
Conditions | Yield |
---|---|
With chloroform; ammonia |
Conditions | Yield |
---|---|
at 130℃; |
Conditions | Yield |
---|---|
With ethanol; ammonia |
Conditions | Yield |
---|---|
Irradiation; |
Conditions | Yield |
---|---|
(i) NH3, Et2O, (ii) (heating); Multistep reaction; |
1,2-bis(1-isocyanato-1-methylethyl)diazene
A
5,5-dimethyl-Δ1-1,2,4-triazolin-3-one
B
methyl carbamate
Conditions | Yield |
---|---|
With methanol for 2h; Heating; Yield given; |
phenoxysulfonyl-carbamic acid methyl ester
A
methanol
B
methyl carbamate
C
phenol
Conditions | Yield |
---|---|
With hydrogen chloride In [D3]acetonitrile at 50℃; Rate constant; Thermodynamic data; other solvent; var. temp. and pH's; ΔH(excit.); ΔS(excit.); deuterium isotope effect; |
(4-chloro-phenoxysulfonyl)-carbamic acid methyl ester
A
methanol
B
4-chloro-phenol
C
methyl carbamate
Conditions | Yield |
---|---|
With hydrogen chloride In [D3]acetonitrile at 50℃; Rate constant; Thermodynamic data; other solvent; var. temp. and pH's; ΔH(excit.); ΔS(excit.); deuterium isotope effect; |
(4-nitro-phenoxysulfonyl)-carbamic acid methyl ester
A
methanol
B
4-nitro-phenol
C
methyl carbamate
Conditions | Yield |
---|---|
With hydrogen chloride In [D3]acetonitrile at 50℃; Rate constant; Thermodynamic data; other solvent; var. temp. and pH's; ΔH(excit.); ΔS(excit.); deuterium isotope effect; |
Conditions | Yield |
---|---|
Stage #1: methyl carbamate With thionyl chloride In diethyl ether at 0 - 20℃; for 0.583333h; Inert atmosphere; Stage #2: With pyridine In diethyl ether at 20℃; for 3h; Inert atmosphere; | 100% |
With pyridine; thionyl chloride In diethyl ether at 0 - 25℃; for 3h; | 76% |
With pyridine; thionyl chloride | |
With pyridine; thionyl chloride In diethyl ether at 0℃; for 3.5h; Inert atmosphere; |
3-amino-5,5-dimethyl-8-nitro-4,5-dihydro-1H-benzo[b]azepin-2(3H)-one
methyl carbamate
(5,5-dimethyl-8-nitro-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl)carbamic acid methyl ester
Conditions | Yield |
---|---|
With N-ethyl-N,N-diisopropylamine In dichloromethane for 0.0833333h; | 100% |
Conditions | Yield |
---|---|
With pyridine; tetrachloromethane; titanium(IV) oxide; vanadia; tungsten(VI) oxide; tin(IV) oxide In N,N-dimethyl-formamide at 120 - 230℃; under 2250.23 - 6000.6 Torr; for 32h; Solvent; Temperature; Pressure; Reagent/catalyst; | 99.1% |
(E)-1,3-diphenyl-2-propen-1-ol
methyl carbamate
(E)-N-(1,3-diphenylallyl) methyl carbamate
Conditions | Yield |
---|---|
With potassium hexafluorophosphate; bismuth(lll) trifluoromethanesulfonate; calcium sulfate In 1,4-dioxane at 23 - 26℃; for 0.2h; | 99% |
With aluminium(III) triflate In nitromethane at 20℃; for 0.166667h; | 94% |
methyl carbamate
Conditions | Yield |
---|---|
With triethylsilane; trifluoroacetic acid In acetonitrile at 70℃; for 24h; Inert atmosphere; | 99% |
Conditions | Yield |
---|---|
With copper(II) bis(trifluoromethanesulfonate) In dichloromethane at 20℃; for 16h; Oleksyszyn Synthesis; | 99% |
methyl carbamate
Conditions | Yield |
---|---|
With silver trifluoromethanesulfonate; triphenylphosphine In toluene at 20℃; for 5h; Inert atmosphere; diastereoselective reaction; | 99% |
N-methylene-tert-butylamine
methyl carbamate
{[tert-Butyl-(methoxycarbonylamino-methyl)-amino]-methyl}-carbamic acid methyl ester
Conditions | Yield |
---|---|
for 3h; Heating; | 98% |
methyl carbamate
Glyoxilic acid
Hydroxy-methoxycarbonylamino-acetic acid
Conditions | Yield |
---|---|
In diethyl ether | 98% |
In diethyl ether | 98% |
With water In diethyl ether | 98% |
Conditions | Yield |
---|---|
With nano-silica-bonded 3-(n-propyl)-1-sulfoimidazolium chloride In neat (no solvent) at 70℃; for 0.216667h; | 98% |
With saccharin sulfonic acid In neat (no solvent) at 70℃; for 0.166667h; Green chemistry; | 97% |
With 4-methyl-4-sulfonic acid morpholinium chloride In neat (no solvent) at 100℃; for 0.05h; Reagent/catalyst; | 97% |
Conditions | Yield |
---|---|
With 4-methyl-4-sulfonic acid morpholinium chloride In neat (no solvent) at 100℃; for 0.0333333h; Catalytic behavior; Concentration; Solvent; Temperature; | 98% |
With nano-silica-bonded 3-(n-propyl)-1-sulfoimidazolium chloride In neat (no solvent) at 70℃; for 0.216667h; | 97% |
With graphene oxide supported imidazolium based dicationic ionic liquid at 80℃; for 0.0833333h; | 97% |
3-nitro-benzaldehyde
methyl carbamate
β-naphthol
methyl ((2-hydroxynaphthalen-1-yl)(3-nitrophenyl)methyl)carbamate
Conditions | Yield |
---|---|
With nano-silica-bonded 3-(n-propyl)-1-sulfoimidazolium chloride In neat (no solvent) at 70℃; for 0.133333h; | 98% |
With trityl chloride In neat (no solvent) at 70℃; for 0.116667h; | 97% |
With a magnetite (Fe3O4 )supported -SO3H functionalized benzimidazolium based ionic liquid In neat (no solvent) at 80℃; for 0.0666667h; Green chemistry; | 97% |
4-nitrobenzaldehdye
methyl carbamate
β-naphthol
methyl N-(2-hydroxynaphthalen-1-yl)(4-nitrophenyl)methyl carbamate
Conditions | Yield |
---|---|
With trityl chloride In neat (no solvent) at 70℃; for 0.133333h; | 98% |
With nano-silica-bonded 3-(n-propyl)-1-sulfoimidazolium chloride In neat (no solvent) at 70℃; for 0.15h; | 98% |
With saccharin sulfonic acid In neat (no solvent) at 70℃; for 0.166667h; Green chemistry; | 97% |
3-Chlorobenzaldehyde
methyl carbamate
β-naphthol
methyl ((3-chlorophenyl)(2-hydroxynaphthalen-1-yl)methyl)carbamate
Conditions | Yield |
---|---|
With trityl chloride In neat (no solvent) at 70℃; for 0.0666667h; | 98% |
With nano-silica-bonded 3-(n-propyl)-1-sulfoimidazolium chloride In neat (no solvent) at 70℃; for 0.2h; | 97% |
With N,N,N-triethyl-N-sulfoethanammonium chloride at 110℃; for 0.166667h; | 94% |
Conditions | Yield |
---|---|
With dirhodium tetraacetate; [bis(acetoxy)iodo]benzene; magnesium oxide In dichloromethane at 20 - 40℃; for 8h; | 98% |
With dirhodium tetraacetate; [bis(acetoxy)iodo]benzene; magnesium oxide In dichloromethane at 40℃; for 8h; | 98% |
Conditions | Yield |
---|---|
With di-n-butyltin maleate In toluene for 3h; Reflux; | 98% |
Conditions | Yield |
---|---|
With di-n-butyltin maleate In toluene for 3h; Reflux; | 98% |
Conditions | Yield |
---|---|
With 4-methyl-4-sulfonic acid morpholinium chloride In neat (no solvent) at 100℃; for 0.05h; Reagent/catalyst; | 97% |
With 1-methyl-3-(4-sulfobutyl)-1H-imidazol-3-ium hydrogensulfate at 90℃; for 2h; Neat (no solvent); | 90% |
With magnesium hydrogen sulfate In neat (no solvent) at 100℃; for 0.383333h; Green chemistry; | 90% |
With 1-n-butyl-3-methylimidazolim bromide; toluene-4-sulfonic acid at 60℃; for 1h; | 75% |
Conditions | Yield |
---|---|
With di-n-butyltin maleate In toluene for 3h; Reflux; | 97% |
Conditions | Yield |
---|---|
In methanol High Pressure; heating at 393-433 K in autoclave; MeOH was distilled off at 343-353 K, drying in vacuo at 333-343 K; elem.anal.; | 96.9% |
methanol
1,6-Hexanediamine
methyl carbamate
1,6-bis(methoxycarbonylamino)hexane
Conditions | Yield |
---|---|
With 5.1 wt% Ni/Fe3O4 at 190℃; under 11251.1 - 16501.7 Torr; for 5h; Autoclave; Inert atmosphere; | 96% |
With cerium(IV) oxide at 150 - 210℃; for 6h; Reagent/catalyst; Temperature; Inert atmosphere; | 96.9% |
cyclohexa-1,3-diene
methyl carbamate
N-(cyclohex-2-enyl) methyl carbamate
Conditions | Yield |
---|---|
With bismuth(lll) trifluoromethanesulfonate; tetrakis(actonitrile)copper(I) hexafluorophosphate; 1,2-bis-(diphenylphosphino)ethane In 1,4-dioxane at 50℃; for 18h; | 96% |
Conditions | Yield |
---|---|
With N,N,N-triethyl-N-sulfoethanammonium chloride at 110℃; for 0.166667h; | 96% |
With trityl chloride In neat (no solvent) at 70℃; for 0.133333h; | 95% |
With saccharin sulfonic acid In neat (no solvent) at 70℃; for 0.0833333h; Green chemistry; | 95% |
methanol
n-Dodecylamine
methyl carbamate
methyl n-dodecylcarbamate
Conditions | Yield |
---|---|
With 5.1 wt% Ni/Fe3O4 at 190℃; under 11251.1 - 16501.7 Torr; for 5h; Autoclave; Inert atmosphere; | 96% |
1-Phenylethanol
methyl carbamate
methyl (1-phenylethyl)carbamate
Conditions | Yield |
---|---|
With aluminium(III) triflate In nitromethane at 50℃; for 0.166667h; Microwave irradiation; | 96% |
methyl carbamate
(Z)-methyl (2-(4-methylphenylsulfonamido)-1-(thiophen-3-yl)vinyl)carbamate
Conditions | Yield |
---|---|
With rhodium(II) octanoate dimer In chloroform at 75℃; Inert atmosphere; Glovebox; Microwave irradiation; stereoselective reaction; | 96% |
4-(4-methoxyphenyl)-1-tosyl-1H-1,2,3-triazole
methyl carbamate
(Z)-methyl (1-(4-methoxyphenyl)-2-(4-methylphenylsulfonamido)vinyl)carbamate
Conditions | Yield |
---|---|
With rhodium(II) octanoate dimer In chloroform at 75℃; Inert atmosphere; Glovebox; Microwave irradiation; stereoselective reaction; | 96% |
p-methylbenzaldoxime methyl ether
methyl carbamate
Conditions | Yield |
---|---|
Stage #1: p-methylbenzaldoxime methyl ether; palladium diacetate In 1,2-dichloro-ethane at 80℃; for 1h; Stage #2: methyl carbamate With dipotassium peroxodisulfate In 1,2-dichloro-ethane at 80℃; | 95% |
The Methyl carbamate, with the CAS registry number 598-55-0 and EINECS registry number 209-939-2, is also known as Methoxyformamide. And the molecular formula of this chemical is C2H5NO2. It is a carbamate ester with th apperance of white adhering crystals. What's more, it is used by the textile industry to manufacture resins to be applied on polyester/cotton blend fabrics as durable-press finishes. And it is also used as intermediate in the pharmaceuticals and Pesticide industry. In addition, it is used as selective solvent for dutrex.
The physical properties of Methyl carbamate are as following: (1)ACD/LogP: -0.68; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.68; (4)ACD/LogD (pH 7.4): -0.68; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 10.15; (8)ACD/KOC (pH 7.4): 10.15; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.399; (14)Molar Refractivity: 16.62 cm3; (15)Molar Volume: 68.7 cm3; (16)Polarizability: 6.59×10-24cm3; (17)Surface Tension: 33.6 dyne/cm; (18)Density: 1.092 g/cm3; (19)Flash Point: 105.2 °C; (20)Enthalpy of Vaporization: 41.5 kJ/mol; (21)Boiling Point: 178.7 °C at 760 mmHg; (22)Vapour Pressure: 0.976 mmHg at 25°C.
Preparation of Methyl carbamate: Heat methyl alcohol to boil, and add urea with stirring. Reflux for 30 hours, and leach for 2 times with boiling sherwood oil. Collect the 175-177 °C distillates after fractionation, and the distillates are the desired product. The yield is about 75%.
1. ClCOOCH3 + 2NH3 → NH2COOCH3
2. NH2CONH2 + CH3OH → NH2COOCH3 + NH3
You should be cautious while dealing with this chemical. It irritates eyes, and there's limited evidence of a carcinogenic effect about this chemical. Therefore, you had better take the following instructions: Do not breathe dust; Wear suitable protective clothing and gloves, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)N
(2)InChI: InChI=1/C2H5NO2/c1-5-2(3)4/h1H3,(H2,3,4)
(3)InChIKey: GTCAXTIRRLKXRU-UHFFFAOYAJ
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 6200mg/kg (6200mg/kg) | National Toxicology Program Technical Report Series. Vol. NTP-TR-328, Pg. 1987, | |
mouse | LD50 | subcutaneous | 4450mg/kg (4450mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) | Australian Journal of Experimental Biology and Medical Science. Vol. 45, Pg. 507, 1967. |
mouse | LDLo | intraperitoneal | 200mg/kg (200mg/kg) | Toxicology and Applied Pharmacology. Vol. 23, Pg. 288, 1972. | |
quail | LD50 | oral | 21mg/kg (21mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: ATAXIA LUNGS, THORAX, OR RESPIRATION: DYSPNEA | Ecotoxicology and Environmental Safety. Vol. 8, Pg. 551, 1984. |
rabbit | LD50 | skin | > 2gm/kg (2000mg/kg) | SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) | Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 161, 1992. |
rat | LD50 | oral | 2500mg/kg (2500mg/kg) | National Toxicology Program Technical Report Series. Vol. NTP-TR-328, Pg. 1987, |
About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia
Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog
©2008 LookChem.com,License: ICP
NO.:Zhejiang16009103
complaints:service@lookchem.com Desktop View