ChemicalBook--->CAS DataBase List--->37045-73-1

37045-73-1

37045-73-1 Structure

37045-73-1 Structure
IdentificationBack Directory
[Name]

N-(3-Aminophenyl)methanesulfamide
[CAS]

37045-73-1
[Synonyms]

N-(3-Aminophenyl)
m-Aminomethylsulfonylaniline
3-(Methylsulfonamido)aniline
n-(3-aminophenyl)methanesulfon
3-(Methylsulfonylamino)aniline
3-N-(Methylsulfonyl)aminoaniline
N-(3-Aminophenyl)methanesulfamide
N-methylsulfonyl-m-phenylenediamine
_x000D_3-(Methylsulfonamido)aniline
N-[(3-aMinophenyl)Methyl]sulfonaMide
N-(3-AMINO PHENYL)METHANE SULFONAMIDE
Methanesulfonamide, N-(3-aminophenyl)-
N-(3-Aminophenyl)methanesulfonamide ,97%
N-(3-AMinophenyl)MethanesulfaMide/N-(3-AMinophenyl)Methanesulfon
N-(3-AMinophenyl)MethanesulfaMide/N-(3-AMinophenyl)MethanesulfonaMide
N-(3-Aminophenyl)methanesulfonamide,N-(3-Aminophenyl)methanesulfamide
[Molecular Formula]

C7H10N2O2S
[MDL Number]

MFCD03094037
[MOL File]

37045-73-1.mol
[Molecular Weight]

186.23
Chemical PropertiesBack Directory
[Melting point ]

117-121 °C (lit.)
[Boiling point ]

361.8±44.0 °C(Predicted)
[density ]

1.408±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[pka]

9.12±0.10(Predicted)
[InChI]

InChI=1S/C7H10N2O2S/c1-12(10,11)9-7-4-2-3-6(8)5-7/h2-5,9H,8H2,1H3
[InChIKey]

UQRRCQRFQGOHAI-UHFFFAOYSA-N
[SMILES]

CS(NC1=CC=CC(N)=C1)(=O)=O
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

29350090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
Hazard InformationBack Directory
[Chemical Properties]

Light red solid
[Uses]

Reactant for:
  • Preparation of biologically and pharmacologically active molecules
[Synthesis]

N-(3-nitrophenyl)methanesulfonamide

63228-62-6

N-(3-Aminophenyl)methanesulfamide

37045-73-1

The general procedure for the synthesis of m-aminomethanesulfonanilide from N-(methylsulfonyl)-3-nitroanilide was as follows: N-(3-nitrophenyl)methanesulfonamide (2.6 g, 12.0 mmol, 1.00 equiv), iron powder (3.38 g, 60.5 mmol, 5.03 equiv) and ammonium chloride (6.48 g, 121 mmol, 10.1 equiv) were dissolved in a solvent mixture of methanol (40 mL) and water (20 mL). The reaction mixture was heated at 70 °C for the reaction. After completion of the reaction, the insoluble material was removed by filtration through diatomaceous earth. The filtrate was concentrated under reduced pressure, diluted with ethyl acetate, washed twice sequentially with saturated saline and the organic phase was dried with anhydrous sodium sulfate. Finally, it was purified by column chromatography (silica gel 115 g, eluent: 20% to 40% ethyl acetate/hexane) to give 1.55 g of orange solid product in 69% yield.

[References]

[1] Patent: WO2014/6066, 2014, A1. Location in patent: Paragraph 0235
[2] Patent: WO2012/59932, 2012, A1. Location in patent: Page/Page column 149-150
[3] ChemMedChem, 2014, vol. 9, # 5, p. 962 - 972
[4] Patent: US2663732, 1950,
Spectrum DetailBack Directory
[Spectrum Detail]

N-(3-Aminophenyl)methanesulfamide(37045-73-1)IR
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