In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 17th, 2004 | 16 | Yes |
Popular Name: 3',5'-bis-Trifluoromethylphenyl acetylene 3',5'-bis-Trifluoromethylphenyl …
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CAS Numbers: 88444-81-9 , [88444-81-9]
1,3-Bis(trifluoromethyl)-5-ethynylbenzene
1-ethynyl-3,5-bis(trifluoromethyl)benzene
3',5'-Bis(trifluoromethyl)phenyl acetylene
3',5'-Bis(trifluoromethyl)phenylacetylene
3,5-Bis(trifluoromethyl)phenylacetylene
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) | 3.42 | 7.7 | -3.25 | 0 | 0 | 0 | 0 | 238.13 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 98% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.