Product Name

  • Name

    Ethyl N-(4-methylphenyl)sulfonylcarbamate

  • EINECS 226-952-9
  • CAS No. 5577-13-9
  • Article Data25
  • CAS DataBase
  • Density 1.261 g/cm3
  • Solubility
  • Melting Point
  • Formula C10H13NO4S
  • Boiling Point 272℃ at 100.8-101kPa
  • Molecular Weight 243.284
  • Flash Point
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 5577-13-9 (Ethyl N-(4-methylphenyl)sulfonylcarbamate)
  • Hazard Symbols
  • Synonyms Carbamicacid, (p-tolylsulfonyl)-, ethyl ester (6CI,7CI,8CI);Carbamic acid,[(4-methylphenyl)sulfonyl]-, ethyl ester (9CI);Ethyl(p-toluenesulfonyl)carbamate;Ethyl (p-tolylsulfonyl)carbamate;EthylN-(4-methylbenzenesulfonyl)carbamate;Ethyl N-tosylcarbamate;Ethylp-tosylcarbamate;N-Tosylurethane;Tosylurethane;
  • PSA 80.85000
  • LogP 2.90150

Synthetic route

4-toluenesulfonyl azide
941-55-9

4-toluenesulfonyl azide

ethanol
64-17-5

ethanol

carbon monoxide
201230-82-2

carbon monoxide

Tosylurethane
5577-13-9

Tosylurethane

Conditions
ConditionsYield
With palladium diacetate In acetonitrile at 20℃; under 15 Torr; for 12h; Schlenk technique; Sealed tube;94%
...Expand
N,N'-carbonyl-bis(4-methylbenzenesulfonamide)
5219-81-8

N,N'-carbonyl-bis(4-methylbenzenesulfonamide)

Diethyl carbonate
105-58-8

Diethyl carbonate

Tosylurethane
5577-13-9

Tosylurethane

Conditions
ConditionsYield
With silica gel-supported lanthanum(III) oxide at 150℃; for 10h; Autoclave; Inert atmosphere;90%
chloroformic acid ethyl ester
541-41-3

chloroformic acid ethyl ester

toluene-4-sulfonamide
70-55-3

toluene-4-sulfonamide

Tosylurethane
5577-13-9

Tosylurethane

Conditions
ConditionsYield
With potassium carbonate In acetone for 4h; Reflux;87%
With sodium hydroxide
ethanol
64-17-5

ethanol

n-butyl tosylcarbamate
31224-37-0

n-butyl tosylcarbamate

Tosylurethane
5577-13-9

Tosylurethane

Conditions
ConditionsYield
at 120℃; for 0.333333h; Sealed tube; Microwave irradiation;84%
toluene-4-sulfonamide
70-55-3

toluene-4-sulfonamide

Hexamethylphosphorous triamide
1608-26-0

Hexamethylphosphorous triamide

Tosylurethane
5577-13-9

Tosylurethane

Conditions
ConditionsYield
With diethylazodicarboxylate In tetrahydrofuran for 2h; Ambient temperature;33%
p-Toluol-(-N-carbethoxy)-iminosulfonsaeurechlorid
93506-31-1

p-Toluol-(-N-carbethoxy)-iminosulfonsaeurechlorid

Tosylurethane
5577-13-9

Tosylurethane

Conditions
ConditionsYield
With potassium hydroxide
4-methylbenzenesulfinyl chloride
10439-23-3

4-methylbenzenesulfinyl chloride

Tosylurethane
5577-13-9

Tosylurethane

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: benzene
2: aq. KOH
View Scheme
Tosyl isocyanate
4083-64-1

Tosyl isocyanate

Tosylurethane
5577-13-9

Tosylurethane

methyl tosylcarbamate
14437-03-7

methyl tosylcarbamate

Tosylurethane
5577-13-9

Tosylurethane

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 0.33 h / 120 °C / Sealed tube; Microwave irradiation
2: 0.33 h / 120 °C / Sealed tube; Microwave irradiation
View Scheme
toluene-4-sulfonamide
70-55-3

toluene-4-sulfonamide

Tosylurethane
5577-13-9

Tosylurethane

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: triethylamine / dichloromethane / 0.17 h / 0 °C
1.2: 2.5 h / 0 - 20 °C
2.1: 0.33 h / 120 °C / Sealed tube; Microwave irradiation
3.1: 0.33 h / 120 °C / Sealed tube; Microwave irradiation
View Scheme
Multi-step reaction with 3 steps
1.1: triethylamine / dichloromethane / 0.17 h / 0 °C
1.2: 2.5 h / 0 - 20 °C
2.1: 0.33 h / 120 °C / Sealed tube; Microwave irradiation
3.1: 0.33 h / 120 °C / Sealed tube; Microwave irradiation
View Scheme

Tosylurethane

Tosylurethane

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: sodium azide / water; acetonitrile / 0.33 h / 20 °C / Schlenk technique
2: palladium diacetate / acetonitrile / 12 h / 20 °C / 15 Torr / Schlenk technique; Sealed tube
View Scheme
Tosylurethane
5577-13-9

Tosylurethane

1-butyn-4-ol
927-74-2

1-butyn-4-ol

O-ehtyl-N-but-3-ynyl-N-(4-methylphenyl)sulfonylcarbamate
349451-03-2

O-ehtyl-N-but-3-ynyl-N-(4-methylphenyl)sulfonylcarbamate

Conditions
ConditionsYield
With triphenylphosphine; diethylazodicarboxylate In tetrahydrofuran at 20℃; for 16h;96%
Tosylurethane
5577-13-9

Tosylurethane

1,1-Diphenylhydrazine
530-50-7

1,1-Diphenylhydrazine

1,1-Diphenyl-4-(4-tosyl)semicarbazid

1,1-Diphenyl-4-(4-tosyl)semicarbazid

Conditions
ConditionsYield
at 130℃; for 2h;88%
Tosylurethane
5577-13-9

Tosylurethane

7-amino-1,3,5-triazaadamantane
14707-75-6

7-amino-1,3,5-triazaadamantane

N-(p-toluenesulfonyl)-N'-[7-(1,3,5-triazaadamantyl)]urea

N-(p-toluenesulfonyl)-N'-[7-(1,3,5-triazaadamantyl)]urea

Conditions
ConditionsYield
In toluene for 10h; Substitution; Heating;79.9%
Tosylurethane
5577-13-9

Tosylurethane

tert-butyl (1-(4-chlorophenyl)-2-methylene-3-oxobutyl) carbonate
1308286-01-2

tert-butyl (1-(4-chlorophenyl)-2-methylene-3-oxobutyl) carbonate

ethyl 1-(4-chlorophenyl)-2-methylene-3-oxobutyl(tosyl)carbamate
1330174-11-2

ethyl 1-(4-chlorophenyl)-2-methylene-3-oxobutyl(tosyl)carbamate

Conditions
ConditionsYield
With 6'-N-phenylformamide-β-ICD In tetrahydrofuran at 20℃; for 72h; optical yield given as %ee;78%
Tosylurethane
5577-13-9

Tosylurethane

glycyclamide
664-95-9

glycyclamide

Conditions
ConditionsYield
In toluene for 6h; Reflux;75%
Tosylurethane
5577-13-9

Tosylurethane

tert-butyl (2-methylene-3-oxo-1-(p-tolyl)butyl) carbonate
1304688-64-9

tert-butyl (2-methylene-3-oxo-1-(p-tolyl)butyl) carbonate

ethyl 2-methylene-3-oxo-1-p-tolylbutyl(tosyl)carbamate
1330174-12-3

ethyl 2-methylene-3-oxo-1-p-tolylbutyl(tosyl)carbamate

Conditions
ConditionsYield
With 6'-N-phenylformamide-β-ICD In tetrahydrofuran at 20℃; for 72h; optical yield given as %ee;72%
Tosylurethane
5577-13-9

Tosylurethane

4-p-Tolylsulfonylsemicarbazid
18258-96-3

4-p-Tolylsulfonylsemicarbazid

Conditions
ConditionsYield
With hydrazine hydrate In ethanol Heating;71%
With hydrazine hydrate In ethanol for 8h; Heating;
Tosylurethane
5577-13-9

Tosylurethane

2-(6-aminopyridin-3-yl)-4-(morpholin-4-yl)-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidine 6,6-dioxide

2-(6-aminopyridin-3-yl)-4-(morpholin-4-yl)-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidine 6,6-dioxide

4-methyl-N-((5-(4-(morpholin-4-yl)-6,6-dioxido-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-2-yl)pyridin-2-yl)carbamoyl)benzenesulfonamide

4-methyl-N-((5-(4-(morpholin-4-yl)-6,6-dioxido-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-2-yl)pyridin-2-yl)carbamoyl)benzenesulfonamide

Conditions
ConditionsYield
In toluene65.3%
Tosylurethane
5577-13-9

Tosylurethane

4-(4-amino-2-fluorophenoxy)-N-methylpicolinamide
757251-42-6

4-(4-amino-2-fluorophenoxy)-N-methylpicolinamide

4-(4-(3-(4-methylbenzenesulfonyl)ureido)-2-fluorophenoxy)-N-methylpyridine-2-carboxamide

4-(4-(3-(4-methylbenzenesulfonyl)ureido)-2-fluorophenoxy)-N-methylpyridine-2-carboxamide

Conditions
ConditionsYield
In toluene for 6h; Reflux;45.3%
Tosylurethane
5577-13-9

Tosylurethane

4"-epi-amino-4"-deoxyavermectin B1a

4"-epi-amino-4"-deoxyavermectin B1a

C56H80N2O16S

C56H80N2O16S

Conditions
ConditionsYield
Reflux;40%
Tosylurethane
5577-13-9

Tosylurethane

2-methoxyethylamine
109-85-3

2-methoxyethylamine

Conditions
ConditionsYield
With 2-methoxy-ethanol
Tosylurethane
5577-13-9

Tosylurethane

3,3-dimethylallylamine
13822-06-5, 108963-90-2

3,3-dimethylallylamine

4-methyl-N-{[(3-methyl-2-butenyl)amino]carbonyl}-benzenesulfonamide
25799-83-1

4-methyl-N-{[(3-methyl-2-butenyl)amino]carbonyl}-benzenesulfonamide

Tosylurethane
5577-13-9

Tosylurethane

3-Methyl-but-2-enoic acid (toluene-4-sulfonylaminocarbonyl)-amide
28490-61-1

3-Methyl-but-2-enoic acid (toluene-4-sulfonylaminocarbonyl)-amide

Tosylurethane
5577-13-9

Tosylurethane

4-Methyl-3-pentenamide
70265-05-3

4-Methyl-3-pentenamide

4-Methyl-pent-3-enoic acid (toluene-4-sulfonylaminocarbonyl)-amide
28490-28-0

4-Methyl-pent-3-enoic acid (toluene-4-sulfonylaminocarbonyl)-amide

Tosylurethane
5577-13-9

Tosylurethane

5-methyl-hex-4-enoic acid amide

5-methyl-hex-4-enoic acid amide

1-(5-methyl-4-hexenoyl)-3-(p-tolylsulfonyl)-urea
28490-29-1

1-(5-methyl-4-hexenoyl)-3-(p-tolylsulfonyl)-urea

Tosylurethane
5577-13-9

Tosylurethane

memantine*
19982-08-2

memantine*

N'--N-<3,5-dimethyl-adamantyl-(1)>-harnstoff
100063-87-4

N'--N-<3,5-dimethyl-adamantyl-(1)>-harnstoff

Tosylurethane
5577-13-9

Tosylurethane

1-Adamantanamine
768-94-5

1-Adamantanamine

N'-p-Toluolsulfonyl-N-adamantyl-(1)-harnstoff
17822-61-6

N'-p-Toluolsulfonyl-N-adamantyl-(1)-harnstoff

Tosylurethane
5577-13-9

Tosylurethane

N-(2-adamantyl)amine
13074-39-0

N-(2-adamantyl)amine

N'--N-<3,5-dimethyl-adamantyl-(2)>-harnstoff
98654-36-5

N'--N-<3,5-dimethyl-adamantyl-(2)>-harnstoff

Tosylurethane
5577-13-9

Tosylurethane

3-methyl-1-aminoadamantane
78056-28-7

3-methyl-1-aminoadamantane

N'--N-<3-methyl-adamantyl>-harnstoff
99998-84-2

N'--N-<3-methyl-adamantyl>-harnstoff

Tosylurethane
5577-13-9

Tosylurethane

1-amino-4-methyl-3-pentene
13296-28-1

1-amino-4-methyl-3-pentene

1-(4-methyl-3-pentenyl)-3-(p-tolylsulfonyl)-urea
28490-23-5

1-(4-methyl-3-pentenyl)-3-(p-tolylsulfonyl)-urea

Tosylurethane
5577-13-9

Tosylurethane

Cinnamyl bromide
4392-24-9

Cinnamyl bromide

ethyl cinnamyl(tosyl)carbamate
32120-97-1

ethyl cinnamyl(tosyl)carbamate

Conditions
ConditionsYield
With sodium 1.) EtOH, RT; 0.5 h, 2.) EtOH, 1 h; Multistep reaction;
Tosylurethane
5577-13-9

Tosylurethane

prenyl bromide
870-63-3

prenyl bromide

C15H21NO4S

C15H21NO4S

Conditions
ConditionsYield
With sodium 1.) EtOH, RT; 0.5 h, 2.) EtOH, 1 h; Multistep reaction;
trans-geranyl bromide
6138-90-5

trans-geranyl bromide

Tosylurethane
5577-13-9

Tosylurethane

ethyl N-geranyl-N-tosylcarbamate
124658-92-0

ethyl N-geranyl-N-tosylcarbamate

Conditions
ConditionsYield
With sodium 1.) EtOH, RT; 0.5 h, 2.) EtOH, 1 h; Yield given. Multistep reaction;

Ethyl N-(4-methylphenyl)sulfonylcarbamate Specification

This chemical is called Carbamic acid, N-[(4-methylphenyl)sulfonyl]-, ethyl ester, and its systematic name is Ethyl ((4-methylphenyl)sulphonyl)carbamate. With the molecular formula of C10H13NO4S, its molecular weight is 243.28. The CAS registry number of this chemical is 5577-13-9.

Other characteristics of theCarbamic acid, N-[(4-methylphenyl)sulfonyl]-, ethyl ester can be summarised as followings: (1)ACD/LogP: 1.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.59; (4)ACD/LogD (pH 7.4): -0.12; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 13.13; (8)ACD/KOC (pH 7.4): 2.59; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 72.06 Å2; (13)Index of Refraction: 1.53; (14)Molar Refractivity: 59.59 cm3; (15)Molar Volume: 192.7 cm3; (16)Polarizability: 23.62×10-24cm3; (17)Surface Tension: 43.6 dyne/cm; (18)Density: 1.261 g/cm3.

You can still convert the following datas into molecular structure: 
1.SMILES: O=S(=O)(c1ccc(cc1)C)NC(=O)OCC
2.InChI: InChI=1/C10H13NO4S/c1-3-15-10(12)11-16(13,14)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H,11,12)
3.InChIKey: DFWQXANLGSXMKF-UHFFFAOYAG

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