| CAS Number | 347146-47-8 |
| Catalog Number | AG00CMPH(AGN-PC-0WCR4H) |
| Chemical Name | 1-Methoxyisoquinolin-6-amine |
| IUPAC Name | 1-methoxyisoquinolin-6-amine |
| InChI | InChI=1S/C10H10N2O/c1-13-10-9-3-2-8(11)6-7(9)4-5-12-10/h2-6H,11H2,1H3 |
| InChI Key | IRVZMXJKUUYKDG-UHFFFAOYSA-N |
| MDL Number | MFCD14706718 |
| Molecular Formula | C10H10N2O |
| Molecular Weight | 174.1992 |
| SMILES | NC1=CC2=C(C(OC)=NC=C2)C=C1 |
| Synonyms | 1-methoxyisoquinolin-6-amine,
347146-47-8,
6-AMINO-1-METHOXYISOQUINOLINE,
SCHEMBL113390,
6-Isoquinolinamine, 1-methoxy-,
CTK4H2888,
DTXSID60627499,
IRVZMXJKUUYKDG-UHFFFAOYSA-N,
ZINC95628737,
AKOS025439964,
QC-7432,
DA-42672,
FT-0721375,
Z1255452173,
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| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.203g/mol |
| Monoisotopic Mass | 174.079g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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