benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate | CAS No. 207857-19-0

benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate

Basic Information

CAS Number

207857-19-0

Molecular Formula

C18H16F3N3O6S

Molecular Weight

459.4 g/mol

AD

Basic Physical Properties

C1=CC=C(C=C1)COC(=O)NC(=NS(=O)(=O)C(F)(F)F)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H16F3N3O6S/c19-18(20,21)31(27,28)24-15(22-16(25)29-11-13-7-3-1-4-8-13)23-17(26)30-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,22,23,24,25,26)

InChIKey

GLZHTZVKRCUQRB-UHFFFAOYSA-N

LogP

3.044800000000002

Topological Polar Surface Area

123.16 Ų

Hydrogen Bond Donor/Acceptor

2 / 9

Complexity

702

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • 1 3-DI-Z-2-(TRIFLUOROMETHYLSULFONYL)-
  • benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate
  • Benzyl N-N-phenylmethoxycarbonyl-N
  • 1,3-Bis(benzyloxycarbonyl)-2-(trifluoromethylsulfonyl)guanidine
  • 1,3-Di-Z-2-(trifluoromethylsulfonyl)guanidine
  • 2-(Trifluoromethylsulfonyl)-1,3-di-Z-guanidine
  • 2-N,N'-di-Cbz-N''-triflylguanidine
  • 97233_ALDRICH
  • 97233_FLUKA
  • AC1N2SPW
  • N,N'-bis(benzyloxycarbonyl)-N''-trifluoromethanesulfonylguan
  • N,N'-bis(benzyloxycarbonyl)-N''-trifluoromethane-sulfonylguanidine
  • N,N'-diCbz-N''-triflylguanidine
  • SureCN2175288
  • SureCN7472350
  • A912130
  • 207857-19-0
  • N,N'-Dicarbobenzyloxy-N''-trifluoromethanesulfonylguanidine
  • Carbamic acid, N,N'-[[(trifluoromethyl)sulfonyl]carbonimidoyl]bis-, C,C'-bis(phenylmethyl) ester
  • SCHEMBL2175288
  • GLZHTZVKRCUQRB-UHFFFAOYSA-N
  • N,N'-bis(benzyloxycarbonyl)-N''-trifluoromethanesulfonylguanidine
  • 1 3-Di-z-2-(trifluoromethylsulfonyl)-
  • DTXSID10399331
  • N-(di{[(benzyloxy)(hydroxy)methylidene]amino}methylidene)-1,1,1-trifluoromethanesulfonamide
  • N,N'-di-cbz-N''-triflylguanidine
  • 1,3-Di-Z-2-(trifluoromethylsulfonyl)guanidine, >=98.0% (HPLC)

MDL Number

MFCD03791132

FAQ

What is benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate (CAS: 207857-19-0)?

Benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate (CAS: 207857-19-0) is a complex organic compound with a broad range of applications in pharmaceuticals and organic synthesis. It is a colorless or white crystalline solid with a melting point around 145-147°C and a molecular weight of approximately 660.98.

What are the main uses of benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate (CAS: 207857-19-0)?

This compound is primarily used as an intermediate in the synthesis of various pharmaceuticals and other organic compounds. It plays a crucial role in the development of new drugs and in the modification of existing ones. Additionally, it is used in research for its unique chemical properties.

Is benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate (CAS: 207857-19-0) safe?

Benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate (CAS: 207857-19-0) is generally considered safe when handled with appropriate precautions. However, it should be stored away from heat, light, and moisture to minimize the risk of decomposition or reaction. Proper protective equipment, such as gloves and safety goggles, should be worn during handling to protect against potential skin or eye contact.

How should benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate (CAS: 207857-19-0) be stored?

Benzyl N-[N-phenylmethoxycarbonyl-N'-(trifluoromethylsulfonyl)carbamimidoyl]carbamate (CAS: 207857-19-0) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. The container should be made of a suitable material to avoid chemical reactions. Ideal storage conditions are below 25°C and with a relative humidity below 60%.

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