In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 12 | Yes |
Popular Name: 2-(4-CHLOROPHENOXY)BUTANE 2-(4-CHLOROPHENOXY)BUTANE
Find On: PubMed — Wikipedia — Google
CAS Number: 51241-52-2
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) | 3.91 | 6.67 | -2.45 | 0 | 1 | 0 | 9 | 184.666 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4963582 | IBM Patent Data |
PUBCHEM_PATENT_ID | US5677263 | IBM Patent Data |