| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 2006 | 14 | Yes |
Popular Name: 1-tert-butyl-4-(prop-2-yn-1-yloxy)benzene 1-tert-butyl-4-(prop-2-yn-1-ylox…
Find On: PubMed — Wikipedia — Google
CAS Number: 48144-15-6
1-tert-Butyl-4-(2-propynyloxy)benzene
1-tert-Butyl-4-(propargyloxy)benzene; p-tert-Butylphenyl 2-propynyl ether
| 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) | 3.86 | 3.51 | -4.5 | 0 | 1 | 0 | 9 | 188.27 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0293768A1; EP0293768B1; US4885403 | IBM Patent Data |
