| CAS Number | 50294-51-4 |
| Catalog Number | AG019ULJ(AGN-PC-0OBA8B) |
| Chemical Name | 2-Aminoadamantane-2-carboxylic acid hydrochloride |
| IUPAC Name | 2-aminoadamantane-2-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C11H17NO2.ClH/c12-11(10(13)14)8-2-6-1-7(4-8)5-9(11)3-6;/h6-9H,1-5,12H2,(H,13,14);1H |
| InChI Key | YANCSAPAJAELIU-UHFFFAOYSA-N |
| MDL Number | MFCD17019471 |
| Molecular Formula | C11H18ClNO2 |
| Molecular Weight | 231.7191 |
| SMILES | Cl.NC1(C2CC3CC(CC1C3)C2)C(=O)O |
| Synonyms | 2-aminoadamantane-2-carboxylic acid hydrochloride,
50294-51-4,
SCHEMBL19834193,
AKOS030757486,
SC-65859,
2-amino-Tricyclo[3.3.1.13,7]decane-2-carboxylic ac,
Z2236664526,
2-amino-Tricyclo[3.3.1.13,7]decane-2-carboxylic acid hydrochloride,
42381-05-5,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.72g/mol |
| Monoisotopic Mass | 231.103g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number