| CAS Number | 207129-36-0 |
| Catalog Number | AG002IUU(AGN-PC-0QWFAL) |
| Chemical Name | 1-Azabicyclo[2.2.2]octane-2-methanol, 5-ethenyl-, (1S,2R,4S,5R)- |
| EC Number | 606-608-8 |
| IUPAC Name | [(2R,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]methanol |
| InChI | InChI=1S/C10H17NO/c1-2-8-6-11-4-3-9(8)5-10(11)7-12/h2,8-10,12H,1,3-7H2/t8-,9?,10+/m0/s1 |
| InChI Key | GAFZBOMPQVRGKU-DJBFQZMMSA-N |
| MDL Number | MFCD08275406 |
| Molecular Formula | C10H17NO |
| Molecular Weight | 167.2481 |
| SMILES | C=C[C@H]1CN2CCC1C[C@@H]2CO |
| Synonyms | (2R,5R)-(+)-5-Vinyl-2-quinuclidinemethanol,
((1S,2R,5R)-5-Vinylquinuclidin-2-yl)methanol,
207129-36-0,
SCHEMBL5178722,
CTK8B4057,
ANW-43784,
RTR-009719,
TR-009719,
J-013543,
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| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.252g/mol |
| Monoisotopic Mass | 167.131g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number