| CAS Number | 1427391-09-0 |
| Catalog Number | AG009ZUT |
| Chemical Name | 7-Bromo-1-methyl-1,2,3,4-tetrahydroquinoxaline |
| IUPAC Name | 6-bromo-4-methyl-2,3-dihydro-1H-quinoxaline |
| InChI | InChI=1S/C9H11BrN2/c1-12-5-4-11-8-3-2-7(10)6-9(8)12/h2-3,6,11H,4-5H2,1H3 |
| InChI Key | AQBNWIOESLEWRM-UHFFFAOYSA-N |
| MDL Number | MFCD23708979 |
| Molecular Formula | C9H11BrN2 |
| Molecular Weight | 227.1010 |
| SMILES | CN1C2=C(C=CC(=C2)Br)NCC1 |
| Synonyms | 7-bromo-1-methyl-1,2,3,4-tetrahydroquinoxaline,
1427391-09-0,
Quinoxaline, 7-bromo-1,2,3,4-tetrahydro-1-methyl-,
SCHEMBL18228428,
ZINC76936269,
AKOS018759233,
|
| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.105g/mol |
| Monoisotopic Mass | 226.011g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number