| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 13 | No |
Popular Name: 3-Methyl-5-(trifluoromethyl)cinnamic acid, JRD, 97% 3-Methyl-5-(trifluoromethyl)cinn…
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CAS Numbers: 1092460-62-2 , 64781-23-3
3,5-Bis(Trifluoromethyl)Cinnamic Acid
3-(3,5-dimethylphenyl)prop-2-enoic acid
| 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) | 2.74 | 7.67 | -49.08 | 0 | 2 | -1 | 40 | 175.207 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 135 - 137 | Enamine Building Blocks |
| MP | 135...137 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.