| CAS Number | 1820580-45-7 |
| Catalog Number | AG00J2R7(AGN-PC-0WRAQ8) |
| Chemical Name | rac-(1R,6R)-6-amino-3-cyclohexene-1-carboxamide hydrochloride |
| IUPAC Name | 6-aminocyclohex-3-ene-1-carboxamide;hydrochloride |
| InChI | InChI=1S/C7H12N2O.ClH/c8-6-4-2-1-3-5(6)7(9)10;/h1-2,5-6H,3-4,8H2,(H2,9,10);1H |
| InChI Key | DITFOZGDBRLNER-UHFFFAOYSA-N |
| MDL Number | MFCD28038727 |
| Molecular Formula | C7H13ClN2O |
| Molecular Weight | 176.6439 |
| SMILES | [C@H]1(CC=CC[C@H]1N)C(N)=O.Cl |
| Synonyms | (1R,6R)-6-Aminocyclohex-3-enecarboxamide hydrochloride,
1820580-45-7,
6-aminocyclohex-3-ene-1-carboxamide hydrochloride,
111302-96-6,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.644g/mol |
| Monoisotopic Mass | 176.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 69.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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