tert-butyl (1S,3R,4R)-3-(hydroxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylate

Base Information

• Chemical Name: tert-butyl (1S,3R,4R)-3-(hydroxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylate
• CAS No.: 553645-75-3
• Molecular Formula: C₁₂H₂₁NO₃
• Molecular Weight: 227.304
• DSSTox Substance ID: DTXSID601124827
• Nikkaji Number: J2.046.332E
• Mol file: 553645-75-3.mol

Synonyms:553645-75-3;tert-butyl (1S,3R,4R)-3-(hydroxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylate;SCHEMBL15934591;DTXSID601124827;AT26896;EN300-7210683;1,1-Dimethylethyl (1S,3R,4R)-3-(hydroxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylate;tert-butyl(1S,3R,4R)-3-(hydroxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylate;(1S,3R,4R)-3-(Hydroxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylic acid tert-butyl ester

Chemical Property of tert-butyl (1S,3R,4R)-3-(hydroxymethyl)-2-azabicyclo[2.2.1]heptane-2-carboxylate

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 227.15214353
• Heavy Atom Count: 16
• Complexity: 285

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1C2CCC(C2)C1CO
• Isomeric SMILES: CC(C)(C)OC(=O)N1[C@H]2CC[C@H](C2)[C@@H]1CO