| CAS Number | 2031268-80-9 |
| Catalog Number | AG01B71V |
| Chemical Name | 1,2,3,4-tetrahydroisoquinoline-5-carboxamide hydrochloride |
| IUPAC Name | 1,2,3,4-tetrahydroisoquinoline-5-carboxamide;hydrochloride |
| InChI | InChI=1S/C10H12N2O.ClH/c11-10(13)9-3-1-2-7-6-12-5-4-8(7)9;/h1-3,12H,4-6H2,(H2,11,13);1H |
| InChI Key | OQXDMIKECXSRDZ-UHFFFAOYSA-N |
| MDL Number | MFCD30345046 |
| Molecular Formula | C10H13ClN2O |
| Molecular Weight | 212.6760 |
| SMILES | Cl.NC(C1=C2C(CNCC2)=CC=C1)=O |
| Synonyms | 1,2,3,4-tetrahydroisoquinoline-5-carboxamide hydrochloride,
2031268-80-9,
AKOS033976837,
Z2680629380,
|
| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.677g/mol |
| Monoisotopic Mass | 212.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number