8-Aminoisoquinolin-1-ol - CAS 216097-69-7
Catalog: |
BB075139 |
Product Name: |
8-Aminoisoquinolin-1-ol |
CAS: |
216097-69-7 |
Synonyms: |
1(2H) - Isoquinolinone, 8- amino- |
IUPAC Name: | 8-amino-2H-isoquinolin-1-one |
Molecular Weight: | 160.17 |
Molecular Formula: | C9H8N2O |
Canonical SMILES: | C1=CC2=C(C(=C1)N)C(=O)NC=C2 |
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 |
Complexity: | 225 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 160.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 160.063662883 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 55.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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