| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 14 | Yes |
Popular Name: 3-(3-ETHOXYPHENYL)PROPIONIC ACID 3-(3-ETHOXYPHENYL)PROPIONIC ACID
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CAS Number: 28945-89-3
3-(3-Ethoxyphenyl)propanoic acid
3-(3-ETHOXYPHENYL)PROPIONIC ACID; [28945-89-3]
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.29 | 1.15 | -47.79 | 0 | 3 | -1 | 49 | 193.222 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 135-140°/1mm | Oakwood Chemical |
| MP | 55-57° | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Purity | 98% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | WO2000001692A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.