| CAS Number | 1523530-50-8 |
| Catalog Number | AG00HXYZ(AGN-PC-0WQZ44) |
| Chemical Name | exo-8-Azabicyclo[3.2.1]octane-3-carboxylic acid hydrochloride |
| IUPAC Name | (1S,5R)-8-azabicyclo[3.2.1]octane-3-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C8H13NO2.ClH/c10-8(11)5-3-6-1-2-7(4-5)9-6;/h5-7,9H,1-4H2,(H,10,11);1H/t5?,6-,7+; |
| InChI Key | MFAUMPVIUINZHM-FXFNDYDPSA-N |
| MDL Number | MFCD27956881 |
| Molecular Formula | C8H14ClNO2 |
| Molecular Weight | 191.6553 |
| SMILES | Cl.OC([C@@H]1C[C@@H]2N[C@@H](CC2)C1)=O |
| Synonyms | exo-8-Azabicyclo[3.2.1]octane-3-carboxylic acid hydrochloride,
68322-48-5,
1523530-50-8,
exo-8-Azabicyclo[3.2.1]octane-3-carboxylic acid HCl,
(3-Endo)-8-azabicyclo[3.2.1]octane-3-carboxylic acid hydrochloride,
(3-exo)-8-azabicyclo[3.2.1]octane-3-carboxylic acid hydrochloride,
(1R,3s,5S)-8-azabicyclo[3.2.1]octane-3-carboxylic acid hydrochloride,
MFCD27956881,
MFCD28893139,
AKOS026670212,
SB10870,
KS-0000045C,
AS-52686,
CS-0058551,
Q-4999,
endo-8-Azabicyclo[3.2.1]octane-3-carboxylic acid hydrochloride,
exo-8-Azabicyclo[3.2.1]octane-3-carboxylicacidhydrochloride-A10640,
N/A,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.655g/mol |
| Monoisotopic Mass | 191.071g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 49.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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