3-[2,6-Di(Propan-2-Yl)Phenyl]-1-[(1-Indol-1-Ylcyclopentyl)Methyl]Urea
[CAS# 145131-11-9]

Identification

• Name: 3-[2,6-Di(Propan-2-Yl)Phenyl]-1-[(1-Indol-1-Ylcyclopentyl)Methyl]Urea
• Synonyms: 3-(2,6-Diisopropylphenyl)-1-[(1-Indol-1-Ylcyclopentyl)Methyl]Urea; 3-(2,6-Diisopropylphenyl)-1-[[1-(1-Indolyl)Cyclopentyl]Methyl]Urea; N(Sup 1)-(1-(1-Indolyl)Cyclopentylmethyl)-N(Sup 2)-(2,6-Diisopropylphenyl)Urea
• Molecular Formula: C₂₇H₃₅N₃O
• Molecular Weight: 417.59
• CAS Registry Number: 145131-11-9
• SMILES: C2=CC1=CC=CC=C1[N]2C4(CNC(NC3=C(C=CC=C3C(C)C)C(C)C)=O)CCCC4
• InChI: 1S/C27H35N3O/c1-19(2)22-11-9-12-23(20(3)4)25(22)29-26(31)28-18-27(15-7-8-16-27)30-17-14-21-10-5-6-13-24(21)30/h5-6,9-14,17,19-20H,7-8,15-16,18H2,1-4H3,(H2,28,29,31)
• InChIKey: WPVMHRFUKNCPJR-UHFFFAOYSA-N

Properties

• Density: 1.122g/cm³ (Cal.)
• Boiling point: 546.875°C at 760 mmHg (Cal.)
• Flash point: 284.54°C (Cal.)