N-Ethyl-2-(Phenylcarbamoyloxy)Propanamide
[CAS# 16118-45-9]

Identification

• Name: N-Ethyl-2-(Phenylcarbamoyloxy)Propanamide
• Synonyms: (2-Ethylamino-1-Methyl-2-Oxo-Ethyl) N-Phenylcarbamate; N-Phenylcarbamic Acid (2-Ethylamino-1-Methyl-2-Oxoethyl) Ester; N-Phenylcarbamic Acid (2-Ethylamino-2-Keto-1-Methyl-Ethyl) Ester
• Molecular Formula: C₁₂H₁₆N₂O₃
• Molecular Weight: 236.27
• CAS Registry Number: 16118-45-9
• SMILES: C1=C(NC(OC(C(NCC)=O)C)=O)C=CC=C1
• InChI: 1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)
• InChIKey: AMRQXHFXNZFDCH-UHFFFAOYSA-N

Properties

• Density: 1.174g/cm³ (Cal.)
• Boiling point: 378.384°C at 760 mmHg (Cal.)
• Flash point: 182.64°C (Cal.)

References

• (1): Igor V. Tetko, Vsevolod Yu. Tanchuk, Tamara N. Kasheva, and Alessandro E. P. Villa. Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices, J. Chem. Inf. Comput. Sci., 2001, 41 (6), pp 1488–1493