| CAS Number | 1016761-78-6 |
| Catalog Number | AG019WW3 |
| Chemical Name | 3-(2-Methoxy-4-methylphenoxy)propanoic acid |
| IUPAC Name | 3-(2-methoxy-4-methylphenoxy)propanoic acid |
| InChI | InChI=1S/C11H14O4/c1-8-3-4-9(10(7-8)14-2)15-6-5-11(12)13/h3-4,7H,5-6H2,1-2H3,(H,12,13) |
| InChI Key | HGDXOMWDJUKJPN-UHFFFAOYSA-N |
| MDL Number | MFCD09811475 |
| Molecular Formula | C11H14O4 |
| Molecular Weight | 210.2265 |
| SMILES | COC1=C(OCCC(O)=O)C=CC(C)=C1 |
| Synonyms | 3-(2-methoxy-4-methylphenoxy)propanoic acid,
1016761-78-6,
AC1Q479K,
CTK6J5576,
ZINC19269200,
AKOS000152395,
MCULE-1511322908,
NE45459,
EN300-53309,
Z839575320,
|
| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.229g/mol |
| Monoisotopic Mass | 210.089g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number