| CAS Number | 723265-09-6 |
| Catalog Number | AG00JDB7(AGN-PC-0WC0NB) |
| Chemical Name | 3-(Ethoxymethyl)-4-methoxybenzoic acid |
| IUPAC Name | 3-(ethoxymethyl)-4-methoxybenzoic acid |
| InChI | InChI=1S/C11H14O4/c1-3-15-7-9-6-8(11(12)13)4-5-10(9)14-2/h4-6H,3,7H2,1-2H3,(H,12,13) |
| InChI Key | YAODNZKZSDFQHS-UHFFFAOYSA-N |
| MDL Number | MFCD07348604 |
| Molecular Formula | C11H14O4 |
| Molecular Weight | 210.2265 |
| SMILES | CCOCC1=C(OC)C=CC(C(O)=O)=C1 |
| Synonyms | 3-(ethoxymethyl)-4-methoxybenzoic acid,
723265-09-6,
AC1OFKVX,
CTK6G3571,
AC1Q3869,
ALBB-004515,
ZINC4218621,
MFCD07348604,
STK503206,
AKOS001160851,
MCULE-3876027603,
NE55617,
NCGC00334785-01,
TR-058275,
EN300-14881,
AB01327452-02,
Z108566770,
CID7131191,
3-(ethoxymethyl)-4-methoxy-benzoic Acid,
|
| 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 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number