| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2004 | 19 | No |
Popular Name: 4-(3',5'-Dimethoxy-4'-formyl)phenoxy butyric acid 4-(3',5'-Dimethoxy-4'-formyl)phe…
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CAS Number: 197304-21-5
4-(3', 5'-Dimethoxy-4'-formyl)phenoxy butyric Acid
4-(4-Formyl-3,5-dimethoxyphenoxy)butyric acid
4-(4-Formyl-3,5-dimethoxyphenoxy)butyric acid, 97%
Butanoic acid, 4-(4-formyl-3,5-dimethoxyphenoxy)-
| 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) | 1.54 | 2.03 | -50.45 | 0 | 6 | -1 | 84 | 267.257 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 96% | Fluorochem |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if presen | Acros Organics |
| R phrase | R36/38: Irritating to eyes and skin. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.