Product Name

  • Name

    N-CHLOROACETYL URETHANE

  • EINECS
  • CAS No. 6092-47-3
  • Article Data9
  • CAS DataBase
  • Density 1.255 g/cm3
  • Solubility Soluble in ethanol and acetone
  • Melting Point 126-131 °C
  • Formula C5H8ClNO3
  • Boiling Point
  • Molecular Weight 165.576
  • Flash Point
  • Transport Information
  • Appearance White or gray crystalline powder with corrosion smell
  • Safety 36/37
  • Risk Codes 21/22
  • Molecular Structure Molecular Structure of 6092-47-3 (N-CHLOROACETYL URETHANE)
  • Hazard Symbols HarmfulXn
  • Synonyms Ethyl (chloroacetyl)carbamate;N-2-Chloroacetylurethane;Ethyl N-(2-chloroacetyl)carbamate;
  • PSA 55.40000
  • LogP 0.88880

Carbamic acid,N-(2-chloroacetyl)-,ethyl ester Specification

The Carbamic acid,N-(2-chloroacetyl)-,ethyl ester, with the CAS registry number of 6092-47-3, is also known as N-2-Chloroacetylurethane. The molecular formula of this chemical is C5H8ClNO3 and its molecular weight is 165.57. What's more, its IUPAC name is Ethyl N-(2-chloroacetyl)carbamate. In addition, it should be stored in airtight containers and placed in a dry, cool place.

Physical properties about Carbamic acid,N-(2-chloroacetyl)-,ethyl ester are: (1)ACD/LogP: 0.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 26.78; (7)ACD/KOC (pH 7.4): 14.95; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 46.61 Å2; (12)Index of Refraction: 1.45; (13)Molar Refractivity: 35.46 cm3; (14)Molar Volume: 131.8 cm3; (15)Polarizability: 14.05×10-24 cm3; (16)Surface Tension: 37.9 dyne/cm; (17)Density: 1.255 g/cm3.

Uses of Carbamic acid,N-(2-chloroacetyl)-,ethyl ester: it is used to produce other chemicals. For example, it can react with Cyano-dithiocarbamic acid methyl ester; potassium salt to produce Methyl-[N-(ethoxycarbonyl)carbamoylmethyl]cyanimidodithiocarbonate at ambient temperature. The reaction needs solvent Acetone. The yield is about 40 %.

Carbamic acid,N-(2-chloroacetyl)-,ethyl ester can be used to produce Methyl-[N-(ethoxycarbonyl)carbamoylmethyl]cyanimidodithiocarbonate.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is harmful in contact with skin and if swallowed. In addition, this chemical may cause damage to health. During using it, wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(NC(=O)OCC)CCl
(2) InChI: InChI=1/C5H8ClNO3/c1-2-10-5(9)7-4(8)3-6/h2-3H2,1H3,(H,7,8,9)
(3) InChIKey: WMKXMEBGSGFRMT-UHFFFAOYAS

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