91971-78-7
Product Name:
Ethyl 3-hydroxy-4-methoxy-mandelate
Formula:
C11H14O5
Synonyms:
3-Hydroxy-4-methoxy-mandelic acid-ethyl ester;Ethyl hydroxy-(3-hydroxy-4-methoxy-phenyl)-acetate;Isovanilmandelic acid-ethyl ester
Inquiry
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral |
| Precautionary Statement Codes |
P280:Wear protective gloves/protective clothing/eye protection/face protection. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 226.23 g/mol |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 226.08412354 g/mol |
| Monoisotopic Mass | 226.08412354 g/mol |
| Topological Polar Surface Area | 76 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 230 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |