In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2004 | 13 | Yes |
Popular Name: 1-(4-Hydroxy-3-methoxymethyl-phenyl)-ethanone 1-(4-Hydroxy-3-methoxymethyl-phe…
Find On: PubMed — Wikipedia — Google
CAS Number: 65033-20-7
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) | 1.71 | 2.07 | -10.55 | 1 | 3 | 0 | 47 | 180.203 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 62 - 64 | Enamine Building Blocks |
MP | 62...64 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
PUBCHEM_PATENT_ID | US4317930; US4376780 | IBM Patent Data |