| CAS Number | 73836-88-1 |
| Catalog Number | AG00ILBF(AGN-PC-0WNGZ1) |
| Chemical Name | (1R,2S,5S)-rel-3-Azabicyclo[3.1.0]hexane-2-carboxylic Acid Hydrochloride |
| IUPAC Name | (1R,2S,5S)-3-azabicyclo[3.1.0]hexane-2-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C6H9NO2.ClH/c8-6(9)5-4-1-3(4)2-7-5;/h3-5,7H,1-2H2,(H,8,9);1H/t3-,4-,5+;/m1./s1 |
| InChI Key | KWBHCTGCOVQKMK-ZDQHTEEMSA-N |
| MDL Number | MFCD20926168 |
| Molecular Formula | C6H10ClNO2 |
| Molecular Weight | 163.6021 |
| SMILES | O=C([C@@H]1[C@]2([H])C[C@]2([H])CN1)O.[H]Cl |
| Synonyms | 73836-88-1,
(1R,2S,5S)-rel-3-azabicyclo[3.1.0]hexane-2-carboxylic acid hydrochloride,
(1R,2S,5S)-rel-3-Azabicyclo[3.1.0]hexane-2-carboxylate hydrochloride,
(1R,2S,5S)-rel-3-Azabicyclo[3.1.0]hexane-2-carboxylic acid HCl,
CTK7I3637,
KS-000006UE,
MFCD20926168,
SB20050,
AS-52837,
CS-0053619,
Q-4568,
927679-50-3,
(1R,2S,5S)-3-AZABICYCLO[3.1.0]HEXANE-2-CARBOXYLIC ACID HYDROCHLORIDE,
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| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.601g/mol |
| Monoisotopic Mass | 163.04g/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
Lot Number