| CAS Number | 1337879-85-2 |
| Catalog Number | AG009EQG(AGN-PC-0WD4O9) |
| Chemical Name | 8-Bromoisoquinolin-1-amine |
| IUPAC Name | 8-bromoisoquinolin-1-amine |
| InChI | InChI=1S/C9H7BrN2/c10-7-3-1-2-6-4-5-12-9(11)8(6)7/h1-5H,(H2,11,12) |
| InChI Key | VEHRKMAFAWPXEB-UHFFFAOYSA-N |
| MDL Number | MFCD21365093 |
| Molecular Formula | C9H7BrN2 |
| Molecular Weight | 223.0693 |
| SMILES | NC1=NC=CC2=CC=CC(Br)=C12 |
| Synonyms | 8-Bromoisoquinolin-1-amine,
1337879-85-2,
1-Amino-8-bromoisoquinoline,
ZX-AT001748,
MFCD21365093,
ZINC95616320,
FCH1563712,
OR300063,
PS-11596,
AX8312308,
C-0429,
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| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.073g/mol |
| Monoisotopic Mass | 221.979g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number