| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 28th, 2010 | 12 | No |
Popular Name: tert-butyl 3-isocyanatopropanoate tert-butyl 3-isocyanatopropanoate
Find On: PubMed — Wikipedia — Google
CAS Number: 884504-55-6
| 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) | 1.08 | 2.04 | -4.29 | 0 | 4 | 0 | 56 | 171.196 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.08 | 3.25 | -40.59 | 1 | 4 | 1 | 57 | 172.204 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
