| CAS Number | 1955564-43-8 |
| Catalog Number | AG01DUC6 |
| Chemical Name | 1,2-Dihydroisoquinolin-1-ylidene(nitroso)methanamine |
| IUPAC Name | (Z)-8aH-isoquinolin-1-ylidene(nitroso)methanamine |
| InChI | InChI=1S/C10H9N3O/c11-10(13-14)9-8-4-2-1-3-7(8)5-6-12-9/h1-6,8H,11H2/b10-9- |
| InChI Key | DPTIXZKGLDWDJU-KTKRTIGZSA-N |
| MDL Number | MFCD26143743 |
| Molecular Formula | C10H9N3O |
| Molecular Weight | 187.198 |
| SMILES | NC(N=O)=C1C2=C(C=CC=C2)C=CN1 |
| Synonyms | 1955564-43-8,
1,2-dihydroisoquinolin-1-ylidene(nitroso)methanamine,
|
| Complexity | 413 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 187.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.202g/mol |
| Monoisotopic Mass | 187.075g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 67.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number