| CAS Number | 1620079-56-2 |
| Catalog Number | AG01C6LH |
| Chemical Name | methyl 1-methyl-1,2,3,4-tetrahydroquinoline-4-carboxylate |
| IUPAC Name | methyl 1-methyl-3,4-dihydro-2H-quinoline-4-carboxylate |
| InChI | InChI=1S/C12H15NO2/c1-13-8-7-10(12(14)15-2)9-5-3-4-6-11(9)13/h3-6,10H,7-8H2,1-2H3 |
| InChI Key | XCPCJJNHYKJTCR-UHFFFAOYSA-N |
| MDL Number | MFCD29991523 |
| Molecular Formula | C12H15NO2 |
| Molecular Weight | 205.2530 |
| SMILES | COC(C1C2=C(C=CC=C2)N(C)CC1)=O |
| Synonyms | methyl 1-methyl-1,2,3,4-tetrahydroquinoline-4-carboxylate,
1620079-56-2,
SCHEMBL19127981,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.257g/mol |
| Monoisotopic Mass | 205.11g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number