(2R)-2-Hydroxy-2-[(R)-1-methoxyethyl]-3-methylbutanoic acid [(7aS)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl ester

Base Information

• Chemical Name: (2R)-2-Hydroxy-2-[(R)-1-methoxyethyl]-3-methylbutanoic acid [(7aS)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl ester
• CAS No.: 488-00-6
• Molecular Formula: C16H27NO4
• Molecular Weight: 297.3899
• DSSTox Substance ID: DTXSID40964117
• Wikidata: Q104915911
• Mol file: 488-00-6.mol

Synonyms:HELEURINE;488-00-6;(2R)-2-Hydroxy-2-[(R)-1-methoxyethyl]-3-methylbutanoic acid [(7aS)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl ester;O(sup 3)-Methylsupinidine;NSC 89940;BRN 0031540;C16H27NO4;5,6,7,8-tetrahydro-3H-pyrrolizin-1-ylmethyl 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoate;DTXSID40964117;AKOS040734856;LS-46322;(2,3,5,7a-Tetrahydro-1H-pyrrolizin-7-yl)methyl 2-hydroxy-2-(1-methoxyethyl)-3-methylbutanoate

Chemical Property of (2R)-2-Hydroxy-2-[(R)-1-methoxyethyl]-3-methylbutanoic acid [(7aS)-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl ester

Chemical Property:

• Vapor Pressure: 2.18E-08mmHg at 25°C
• Boiling Point: 408.8°Cat760mmHg
• Flash Point: 201°C
• PSA: 59.00000
• Density: 1.12g/cm³
• LogP: 1.29390
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 297.19400834
• Heavy Atom Count: 21
• Complexity: 421

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C(C)OC)(C(=O)OCC1=CCN2C1CCC2)O