| CAS Number | 1203372-02-4 |
| Catalog Number | AG008UQC(AGN-PC-0WAC3Q) |
| Chemical Name | 7-Bromomethylisoquinoline hydrobromide |
| IUPAC Name | 7-(bromomethyl)isoquinoline;hydrobromide |
| InChI | InChI=1S/C10H8BrN.BrH/c11-6-8-1-2-9-3-4-12-7-10(9)5-8;/h1-5,7H,6H2;1H |
| InChI Key | ILUMYCASODISJM-UHFFFAOYSA-N |
| MDL Number | MFCD12022338 |
| Molecular Formula | C10H9Br2N |
| Molecular Weight | 302.9932 |
| SMILES | BrCC1=CC2=C(C=C1)C=CN=C2.[H]Br |
| Synonyms | 7-(bromomethyl)isoquinoline hydrobromide,
1203372-02-4,
7-BROMOMETHYLISOQUINOLINE HYDROBROMIDE,
DTXSID40678464,
ZX-AT003539,
6032AH,
MFCD12022338,
OR43505,
PS-9930,
C-2359,
7-(Bromomethyl)isoquinoline--hydrogen bromide (1/1),
C10H8BrN.HBr,
7-(Bromomethyl)isoquinoline,
7-(Bromomethyl)-2-azanaphthalene hydrobromide,
7-(bromomethyl)isoquinoline hydrobromide, 95% - 1G 1g,
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| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 302.908g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 302.997g/mol |
| Monoisotopic Mass | 300.91g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number