| CAS Number | 106981-52-6 |
| Catalog Number | AG008X1Z(AGN-PC-02ONQY) |
| Chemical Name | 2-(4-Amino-2-ethoxyphenyl)pthalimide |
| IUPAC Name | 2-(4-amino-2-ethoxyphenyl)isoindole-1,3-dione |
| InChI | InChI=1S/C16H14N2O3/c1-2-21-14-9-10(17)7-8-13(14)18-15(19)11-5-3-4-6-12(11)16(18)20/h3-9H,2,17H2,1H3 |
| InChI Key | CWFMBSOEQIOZAR-UHFFFAOYSA-N |
| MDL Number | MFCD18379165 |
| Molecular Formula | C16H14N2O3 |
| Molecular Weight | 282.2940 |
| SMILES | CCOc1cc(N)ccc1N2C(=O)c3ccccc3C2=O |
| Synonyms | 106981-52-6,
2-(4-Amino-2-ethoxyphenyl)isoindoline-1,3-dione,
2-(4-amino-2-ethoxyphenyl)isoindole-1,3-dione,
2-(4-Amino-2-ethoxyphenyl)pthalimide,
2-(4-Amino-2-ethoxyphenyl)-1H-isoindole-1,3(2H)-dione,
SCHEMBL10915755,
DTXSID70603906,
CWFMBSOEQIOZAR-UHFFFAOYSA-N,
MFCD18379165,
ZINC59451117,
FT-0661774,
3-ethoxy-4-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)aniline,
|
| Complexity | 402 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 282.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 282.299g/mol |
| Monoisotopic Mass | 282.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 72.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number