| CAS Number | 34967-25-4 |
| Catalog Number | AG01X5ID(AGN-PC-00N8LH) |
| Chemical Name | 3,5-Dimethoxybenzaldehyde oxime |
| IUPAC Name | N-[(3,5-dimethoxyphenyl)methylidene]hydroxylamine |
| InChI | InChI=1S/C9H11NO3/c1-12-8-3-7(6-10-11)4-9(5-8)13-2/h3-6,11H,1-2H3 |
| InChI Key | XSZCYTHSFYOECU-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO3 |
| Molecular Weight | 181.1885 |
| SMILES | COc1cc(C=NO)cc(c1)OC |
| Synonyms | N-[(3,5-dimethoxyphenyl)methylidene]hydroxylamine,
1262150-79-7,
3,5-Dimethoxybenzaldehyde oxime,
AKOS017263658,
ZINC242722738,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.191g/mol |
| Monoisotopic Mass | 181.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number