2,2-Dimethyl-N-[3-(N-Tert-Butylcarbamoyloxy)Phenyl]Valeramide
[CAS# 17795-80-1]

Identification

• Name: 2,2-Dimethyl-N-[3-(N-Tert-Butylcarbamoyloxy)Phenyl]Valeramide
• Synonyms: N-Tert-Butylcarbamic Acid [3-[(2,2-Dimethyl-1-Oxopentyl)Amino]Phenyl] Ester; N-Tert-Butylcarbamic Acid [3-(2,2-Dimethylpentanoylamino)Phenyl] Ester; Valeranilide, 3'-Hydroxy-2,2-Dimethyl-, Tert-Butylcarbamate (Ester)
• Molecular Formula: C₁₈H₂₈N₂O₃
• Molecular Weight: 320.43
• CAS Registry Number: 17795-80-1
• SMILES: C1=CC=C(C=C1NC(C(CCC)(C)C)=O)OC(=O)NC(C)(C)C
• InChI: 1S/C18H28N2O3/c1-7-11-18(5,6)15(21)19-13-9-8-10-14(12-13)23-16(22)20-17(2,3)4/h8-10,12H,7,11H2,1-6H3,(H,19,21)(H,20,22)
• InChIKey: PNJZAJBZQHXCMJ-UHFFFAOYSA-N

Properties

• Density: 1.064g/cm³ (Cal.)
• Boiling point: 458.219°C at 760 mmHg (Cal.)
• Flash point: 230.923°C (Cal.)