In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2004 | 9 | Yes |
Popular Name: 3-Methylbut-2-en-1-yl acetate 3-Methylbut-2-en-1-yl acetate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1191-16-8 , [1191-16-8]
3,3-Dimethylallyl acetate, 98%, stab. with 0.1% alpha tocopherol
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) | 2.06 | 2.79 | -5.24 | 0 | 2 | 0 | 26 | 128.171 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP | 128 / 353 | TCI |
Boiling_Point | 140? | Alfa-Aesar |
Boiling_Point | 140° | Alfa-Aesar |
Purity | 95% | Fluorochem |