| CAS Number | 219310-11-9 |
| Catalog Number | AG01C0AH |
| Chemical Name | (3R)-3-Amino-3-Cyclohexylpropanoic Acid Hydrochloride |
| IUPAC Name | (3R)-3-amino-3-cyclohexylpropanoic acid;hydrochloride |
| InChI | InChI=1S/C9H17NO2.ClH/c10-8(6-9(11)12)7-4-2-1-3-5-7;/h7-8H,1-6,10H2,(H,11,12);1H/t8-;/m1./s1 |
| InChI Key | KGHIZRPOMNZQAX-DDWIOCJRSA-N |
| MDL Number | MFCD30497901 |
| Molecular Formula | C9H18ClNO2 |
| Molecular Weight | 207.6977 |
| SMILES | O=C(O)C[C@@H](N)C1CCCCC1.[H]Cl |
| Synonyms | 219310-11-9,
(3R)-3-amino-3-cyclohexylpropanoic acid hydrochloride,
SCHEMBL6778604,
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| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.698g/mol |
| Monoisotopic Mass | 207.103g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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