| CAS Number | 1232149-37-9 |
| Catalog Number | AG01EL69 |
| Chemical Name | 7-bromoquinoline-3,4-diamine |
| IUPAC Name | 7-bromoquinoline-3,4-diamine |
| InChI | InChI=1S/C9H8BrN3/c10-5-1-2-6-8(3-5)13-4-7(11)9(6)12/h1-4H,11H2,(H2,12,13) |
| InChI Key | SYMORBBHPXGJHS-UHFFFAOYSA-N |
| MDL Number | MFCD24387231 |
| Molecular Formula | C9H8BrN3 |
| Molecular Weight | 238.0839 |
| SMILES | NC1=C(N)C2=C(C=C(C=C2)Br)N=C1 |
| Synonyms | 7-bromoquinoline-3,4-diamine,
1232149-37-9,
7-bromo-3,4-diaminoquinoline,
SCHEMBL20476253,
ZINC231447342,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 238.088g/mol |
| Monoisotopic Mass | 236.99g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 64.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number