3-Methylbutyl N-[2-Di(Phenyl)Phosphoryl-1,1,1,3,3,3-Hexafluoropropan-2-Yl]Carbamate
[CAS# 145430-08-6]

Identification

• Name: 3-Methylbutyl N-[2-Di(Phenyl)Phosphoryl-1,1,1,3,3,3-Hexafluoropropan-2-Yl]Carbamate
• Synonyms: Isopentyl N-[1-Di(Phenyl)Phosphoryl-2,2,2-Trifluoro-1-(Trifluoromethyl)Ethyl]Carbamate; N-[1-Di(Phenyl)Phosphoryl-2,2,2-Trifluoro-1-(Trifluoromethyl)Ethyl]Carbamic Acid Isopentyl Ester; N-[1-Di(Phenyl)Phosphoryl-2,2,2-Trifluoro-1-(Trifluoromethyl)Ethyl]Carbamic Acid Isoamyl Ester
• Molecular Formula: C₂₁H₂₂F₆NO₃P
• Molecular Weight: 481.37
• CAS Registry Number: 145430-08-6
• SMILES: C1=CC=CC=C1[P](C(NC(=O)OCCC(C)C)(C(F)(F)F)C(F)(F)F)(=O)C2=CC=CC=C2
• InChI: 1S/C21H22F6NO3P/c1-15(2)13-14-31-18(29)28-19(20(22,23)24,21(25,26)27)32(30,16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3,(H,28,29)
• InChIKey: RXYZJSFQYLLONF-UHFFFAOYSA-N

Properties

• Density: 1.319g/cm³ (Cal.)
• Boiling point: 447.209°C at 760 mmHg (Cal.)
• Flash point: 224.264°C (Cal.)