| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2012 | 12 | Yes |
Popular Name: trans,trans,trans-1,5,9-Cyclododecatriene, 97%, stab. with 30-50ppm 4-tert-butylcatechol trans,trans,trans-1,5,9-Cyclodod…
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CAS Number: 676-22-2
| 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) | 4.54 | 8.38 | -0.66 | 0 | 0 | 0 | 0 | 162.276 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 237-238? | Alfa-Aesar |
| Boiling_Point | 237-238° | Alfa-Aesar |
| Melting_Point | 32-34? | Alfa-Aesar |
| Melting_Point | 32-34° | Alfa-Aesar |
No pre-computed analogs available. Try a structural similarity search.