Rodocaine
[CAS# 38821-80-6]

Identification

• Name: Rodocaine
• Synonyms: 3-[(4Ar,7As)-2,3,4,4A,5,6,7,7A-Octahydrocyclopenta[B]Pyridin-1-Yl]-N-(2-Chloro-6-Methyl-Phenyl)Propanamide; 3-[(4Ar,7As)-2,3,4,4A,5,6,7,7A-Octahydro-1-Pyrindin-1-Yl]-N-(2-Chloro-6-Methyl-Phenyl)Propionamide; 1H-1-Pyrindine-1-Propanamide, N-(2-Chloro-6-Methylphenyl)Octahydro-, Trans-(+)-
• Molecular Formula: C₁₈H₂₅ClN₂O
• Molecular Weight: 320.86
• CAS Registry Number: 38821-80-6
• SMILES: [C@@H]12[C@H](CCC1)CCCN2CCC(NC3=C(C=CC=C3Cl)C)=O
• InChI: 1S/C18H25ClN2O/c1-13-5-2-8-15(19)18(13)20-17(22)10-12-21-11-4-7-14-6-3-9-16(14)21/h2,5,8,14,16H,3-4,6-7,9-12H2,1H3,(H,20,22)/t14-,16+/m1/s1
• InChIKey: ICLIXBRUSBYXEV-ZBFHGGJFSA-N

Properties

• Density: 1.167g/cm³ (Cal.)
• Boiling point: 478.335°C at 760 mmHg (Cal.)
• Flash point: 243.089°C (Cal.)