| CAS Number | 216097-69-7 |
| Catalog Number | AG00C2YQ(AGN-PC-0WOQOJ) |
| Chemical Name | 8-Aminoisoquinolin-1-Ol |
| IUPAC Name | 8-amino-2H-isoquinolin-1-one |
| InChI | InChI=1S/C9H8N2O/c10-7-3-1-2-6-4-5-11-9(12)8(6)7/h1-5H,10H2,(H,11,12) |
| InChI Key | UXMPRYSFGIABNF-UHFFFAOYSA-N |
| MDL Number | MFCD22380561 |
| Molecular Formula | C9H8N2O |
| Molecular Weight | 160.1726 |
| SMILES | NC1=C2C(C=CNC2=O)=CC=C1 |
| Synonyms | 8-Aminoisoquinolin-1-ol,
216097-69-7,
8-amino-1,2-dihydroisoquinolin-1-one,
1(2H)-Isoquinolinone, 8-amino-,
8-amino-2H-isoquinolin-1-one,
SCHEMBL3934745,
MFCD22380561,
ZINC34580014,
AKOS026741206,
MCULE-5549744189,
C-0223,
8-AMINOISOQUINOLIN-1-OL[216097-69-7],
Z1861964144,
|
| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 160.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 160.176g/mol |
| Monoisotopic Mass | 160.064g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number