| CAS Number | 104736-35-8 |
| Catalog Number | AG008SAT(AGN-PC-0KPYU0) |
| Chemical Name | 5-Ethoxy-4-methoxy-2-methylbenzaldehyde |
| IUPAC Name | 5-ethoxy-4-methoxy-2-methylbenzaldehyde |
| InChI | InChI=1S/C11H14O3/c1-4-14-11-6-9(7-12)8(2)5-10(11)13-3/h5-7H,4H2,1-3H3 |
| InChI Key | URUSALADQYHRFL-UHFFFAOYSA-N |
| MDL Number | MFCD06247357 |
| Molecular Formula | C11H14O3 |
| Molecular Weight | 194.2271 |
| SMILES | CCOc1cc(C=O)c(cc1OC)C |
| Synonyms | 5-ethoxy-4-methoxy-2-methylbenzaldehyde,
5-Ethoxy-4-methoxy-2-methyl-benzaldehyde,
104736-35-8,
AC1MKMNA,
CTK6G0717,
DTXSID20390258,
ZINC4384489,
8024AC,
AKOS000302788,
MCULE-8666589904,
BAS 10159560,
BB0259460,
TR-056115,
BB 0259460,
ST50289717,
C11H14O3,
ZINC04384489,
CID3159724,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.23g/mol |
| Monoisotopic Mass | 194.094g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number