| CAS Number | 186895-24-9 |
| Catalog Number | AG019F0G(AGN-PC-0357Q7) |
| Chemical Name | ethyl 3-[4-(benzyloxy)-3-methoxyphenyl]propanoate |
| IUPAC Name | ethyl 3-(3-methoxy-4-phenylmethoxyphenyl)propanoate |
| InChI | InChI=1S/C19H22O4/c1-3-22-19(20)12-10-15-9-11-17(18(13-15)21-2)23-14-16-7-5-4-6-8-16/h4-9,11,13H,3,10,12,14H2,1-2H3 |
| InChI Key | BTDYMMIKNRYPMQ-UHFFFAOYSA-N |
| MDL Number | MFCD31652797 |
| Molecular Formula | C19H22O4 |
| Molecular Weight | 314.3756 |
| SMILES | CCOC(=O)CCc1ccc(OCc2ccccc2)c(OC)c1 |
| Synonyms | 3-(4-Benzyloxy-3-methoxy-phenyl)-propionic acid ethyl ester,
186895-24-9,
SCHEMBL5881099,
CS-0059803,
Ethyl 3-(4-(benzyloxy)-3-methoxyphenyl)propanoate,
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| Complexity | 338 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 314.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 314.381g/mol |
| Monoisotopic Mass | 314.152g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 44.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number