| CAS Number | 953726-89-1 |
| Catalog Number | AG01AA3J(AGN-PC-0WO0BL) |
| Chemical Name | 8-Methoxy-5-methyl-1,2,3,4-tetrahydroquinoline |
| IUPAC Name | 8-methoxy-5-methyl-1,2,3,4-tetrahydroquinoline |
| InChI | InChI=1S/C11H15NO/c1-8-5-6-10(13-2)11-9(8)4-3-7-12-11/h5-6,12H,3-4,7H2,1-2H3 |
| InChI Key | DQAJTBHMPZTUNX-UHFFFAOYSA-N |
| MDL Number | MFCD09736265 |
| Molecular Formula | C11H15NO |
| Molecular Weight | 177.2429 |
| SMILES | COC1=C2C(CCCN2)=C(C)C=C1 |
| Synonyms | 8-methoxy-5-methyl-1,2,3,4-tetrahydroquinoline,
953726-89-1,
AC1Q47CT,
CTK7A1504,
ZINC22215034,
AKOS000143963,
MCULE-8431345778,
NE34104,
EN300-66926,
Z1263529744,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.247g/mol |
| Monoisotopic Mass | 177.115g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number