| CAS Number | 1429765-70-7 |
| Catalog Number | AG01AFGO |
| Chemical Name | 2-Iodo-1-methoxy-4-nitronaphthalene |
| IUPAC Name | 2-iodo-1-methoxy-4-nitronaphthalene |
| InChI | InChI=1S/C11H8INO3/c1-16-11-8-5-3-2-4-7(8)10(13(14)15)6-9(11)12/h2-6H,1H3 |
| InChI Key | LCSOITAPPJSAGU-UHFFFAOYSA-N |
| MDL Number | MFCD28118198 |
| Molecular Formula | C11H8INO3 |
| Molecular Weight | 329.0906 |
| SMILES | COC1=C2C(C=CC=C2)=C([N+]([O-])=O)C=C1I |
| Synonyms | 2-Iodo-1-methoxy-4-nitronaphthalene,
1429765-70-7,
SCHEMBL14842540,
LCSOITAPPJSAGU-UHFFFAOYSA-N,
ZINC98113587,
|
| Complexity | 268 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 328.955g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 329.093g/mol |
| Monoisotopic Mass | 328.955g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number