| CAS Number | 3535-24-8 |
| Catalog Number | AG00I70M(AGN-PC-0JTFRD) |
| Chemical Name | Methyl 4-ethoxy-3-methoxybenzoate |
| IUPAC Name | methyl 4-ethoxy-3-methoxybenzoate |
| InChI | InChI=1S/C11H14O4/c1-4-15-9-6-5-8(11(12)14-3)7-10(9)13-2/h5-7H,4H2,1-3H3 |
| InChI Key | HVLQOCXAZMSAPT-UHFFFAOYSA-N |
| MDL Number | MFCD06203685 |
| Molecular Formula | C11H14O4 |
| Molecular Weight | 210.2265 |
| SMILES | CCOC1C=CC(C(OC)=O)=CC=1OC |
| Synonyms | Methyl 4-ethoxy-3-methoxybenzoate,
3535-24-8,
HVLQOCXAZMSAPT-UHFFFAOYSA-N,
4-ethoxy-3-methoxybenzoic acid methyl ester,
AC1LC0HP,
SCHEMBL1015707,
Methyl 3-methoxy-4-ethoxybenzoate,
Methyl 4-ethoxy-3-methoxybenzoate #,
ZINC32191269,
AKOS016997099,
3-Methoxy-4-ethoxybenzoic acid methyl ester,
Benzoic acid, 4-ethoxy-3-methoxy-, methyl ester,
CID592192,
|
| 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 | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.229g/mol |
| Monoisotopic Mass | 210.089g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 44.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number