(3aS,8aR)-1,3A,8-Trimethyl-1,2,3,3A,8,8A-Hexahydropyrrolo[2,3-b]Indol-5-Yl Dimethylcarbamate
[CAS# 103877-07-2]

Identification

• Classification: Analytical chemistry >> Standard >> Forensic and veterinary standards
• Name: (3aS,8aR)-1,3A,8-Trimethyl-1,2,3,3A,8,8A-Hexahydropyrrolo[2,3-b]Indol-5-Yl Dimethylcarbamate
• Synonyms: (-)-Dimethyl-carbamic acid 1,3a,8-trimethyl-1,2,3,3a,8,8a-hexahydro-pyrrolo[2,3-b]indol-5-yl ester; (-)-N-Methylphysostigmine; (−)-N-Methylphysostigmine
• Molecular Formula: C₁₆H₂₃N₃O₂
• Molecular Weight: 289.37
• CAS Registry Number: 103877-07-2
• SMILES: C[C@@]12CCN([C@@H]1N(C3=C2C=C(C=C3)OC(=O)N(C)C)C)C
• InChI: 1S/C16H23N3O2/c1-16-8-9-18(4)14(16)19(5)13-7-6-11(10-12(13)16)21-15(20)17(2)3/h6-7,10,14H,8-9H2,1-5H3/t14-,16+/m1/s1
• InChIKey: IUHMWLMDASQDJQ-ZBFHGGJFSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 406.7±45.0°C at 760 mmHg (Cal.)
• Flash point: 199.8±28.7°C (Cal.)
• Refractive index: 1.567 (Cal.)