| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 12 | No |
Popular Name: 2-Chlorocinnamic acid 2-Chlorocinnamic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 3752-25-8 , 939-58-2 , [3752-25-8]
(2E)-3-(2-chlorophenyl)-2-propenoicacid
(2E)-3-(2-chlorophenyl)acrylic acid
(E)-3-(2-chlorophenyl)-2-propenoic acid
(E)-3-(2-Chlorophenyl)acrylic acid
2-Chlorocinnamic acid, predominantly trans
2-Chlorocinnamic acid, predominantly trans, 99%
2-CHLOROCINNAMIC ACID; [3752-25-8]
2-propenoic acid, 3-(2-chlorophenyl)-
| 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) | 2.36 | 0.96 | -50.7 | 0 | 2 | -1 | 40 | 181.598 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 150 - 152 | Enamine Building Blocks |
| MP | 150...152 | Enamine Building Blocks |
| M.P | 208-210 °C | Indofine |
| MP | 208-210° | Matrix Scientific |
| Melting_Point | 209-212? | Alfa-Aesar |
| Melting_Point | 209-212° | Alfa-Aesar |
| MP | 210 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 99% | Matrix Scientific |
| Warnings | Irritant | Matrix Scientific |
