| CAS Number | 1824282-29-2 |
| Catalog Number | AG0023VF(AGN-PC-0WANDN) |
| Chemical Name | tert-Butyl (2-methylquinolin-3-yl)carbamate |
| IUPAC Name | tert-butyl N-(2-methylquinolin-3-yl)carbamate |
| InChI | InChI=1S/C15H18N2O2/c1-10-13(17-14(18)19-15(2,3)4)9-11-7-5-6-8-12(11)16-10/h5-9H,1-4H3,(H,17,18) |
| InChI Key | RMKRHOFUUVQKGO-UHFFFAOYSA-N |
| MDL Number | MFCD19689605 |
| Molecular Formula | C15H18N2O2 |
| Molecular Weight | 258.3156 |
| SMILES | CC1=NC2=CC=CC=C2C=C1NC(=O)OC(C)(C)C |
| Synonyms | tert-Butyl (2-methylquinolin-3-yl)carbamate,
1824282-29-2,
MFCD19689605,
ZINC95931315,
AKOS022177982,
AK-46970,
DS-14170,
t-Butyl (2-methylquinolin-3-yl)carbamate,
AJ-136987,
CS-0061394,
(2-Methylquinolin-3-yl)carbamic acid tert-butyl ester,
Carbamic acid, N-(2-methyl-3-quinolinyl)-, 1,1-dimethylethyl ester,
|
| Complexity | 325 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.321g/mol |
| Monoisotopic Mass | 258.137g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number