1-Methyl-2beta-Benzyl-5beta-Nonylpyrrolidine-3beta-Ol
[CAS# 125356-66-3]

Identification

• Name: 1-Methyl-2beta-Benzyl-5beta-Nonylpyrrolidine-3beta-Ol
• Synonyms: (2S,3S,5R)-1-Methyl-5-Nonyl-2-(Phenylmethyl)-3-Pyrrolidinol; (2S,3S,5R)-2-(Benzyl)-1-Methyl-5-Nonyl-Pyrrolidin-3-Ol
• Molecular Formula: C₂₁H₃₅NO
• Molecular Weight: 317.51
• CAS Registry Number: 125356-66-3
• SMILES: [C@H]1(N([C@@H](C[C@@H]1O)CCCCCCCCC)C)CC2=CC=CC=C2
• InChI: 1S/C21H35NO/c1-3-4-5-6-7-8-12-15-19-17-21(23)20(22(19)2)16-18-13-10-9-11-14-18/h9-11,13-14,19-21,23H,3-8,12,15-17H2,1-2H3/t19-,20+,21+/m1/s1
• InChIKey: GBCXKHLKJHRTAB-HKBOAZHASA-N

Properties

• Density: 0.967g/cm³ (Cal.)
• Boiling point: 432.142°C at 760 mmHg (Cal.)
• Flash point: 11.141°C (Cal.)