| CAS Number | 915865-96-2 |
| Catalog Number | AG003N9U(AGN-PC-0WAC12) |
| Chemical Name | 6-Methoxyisoquinoline, HCl |
| IUPAC Name | 6-methoxyisoquinoline;hydrochloride |
| InChI | InChI=1S/C10H9NO.ClH/c1-12-10-3-2-9-7-11-5-4-8(9)6-10;/h2-7H,1H3;1H |
| InChI Key | MHJDVDRMCCCPHE-UHFFFAOYSA-N |
| MDL Number | MFCD12546534 |
| Molecular Formula | C10H10ClNO |
| Molecular Weight | 195.6455 |
| SMILES | Cl.COC1=CC2=C(C=NC=C2)C=C1 |
| Synonyms | 6-Methoxyisoquinoline hydrochloride,
915865-96-2,
6-methoxyisoquinoline, hcl,
6-Methoxyisoquinoline HCl,
DTXSID00675212,
6-methoxyisoquinoline;hydrochloride,
MFCD12546534,
AKOS015897185,
AX8251629,
TC-061124,
V9105,
B-5352,
EN300-220920,
6-Methoxyisoquinoline--hydrogen chloride (1/1),
I08-985,
C10H9NO.HCl,
4-Carboxylic-isatoic anhydride,
6-Methoxyisoquinolinehydrochloride,
77423-14-4,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.646g/mol |
| Monoisotopic Mass | 195.045g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number