| CAS Number | 129848-93-7 |
| Catalog Number | AG00HRZB(AGN-PC-0PJ2JM) |
| Chemical Name | L-1,2,3,4-Tetrahydronorharman-3-carboxylic acid ethyl ester hydrochloride |
| IUPAC Name | ethyl (3S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate;hydrochloride |
| InChI | InChI=1S/C14H16N2O2.ClH/c1-2-18-14(17)12-7-10-9-5-3-4-6-11(9)16-13(10)8-15-12;/h3-6,12,15-16H,2,7-8H2,1H3;1H/t12-;/m0./s1 |
| InChI Key | RAARNKBGEZGYMA-YDALLXLXSA-N |
| MDL Number | MFCD22690656 |
| Molecular Formula | C14H17ClN2O2 |
| Molecular Weight | 280.7500 |
| SMILES | CCOC(=O)[C@H]1NCc2c(C1)c1ccccc1[nH]2.Cl |
| Synonyms | 129848-93-7,
H-Tpi-oet hcl,
H-Tpi-OEt hydrochloride,
L-1,2,3,4-Tetrahydronorharman-3-carboxylic acid ethyl ester hydrochloride,
MFCD06795858,
|
| Complexity | 321 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 280.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.752g/mol |
| Monoisotopic Mass | 280.098g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number