In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 27 | Yes |
Popular Name: 4-n-Propylcyclohexyl [trans[trans(trans)]]-4'-n-propylbicyclohexyl-4-carboxylate 4-n-Propylcyclohexyl [trans[tran…
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CAS Number: 83242-83-5
4-n-Propylcyclohexyl [trans[trans(trans)]]-4'-n-propylbicyclohexyl-4-carboxylate 12352100
trans-4-n-Propylcyclohexyl trans,trans-4'-n-propylbicyclohexyl-4-carboxylate
trans-4-n-Propylcyclohexyl trans,trans-4'-n-propylbicyclohexyl-4-carboxylate, 97%
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) | 8.08 | 16.66 | -3.52 | 0 | 2 | 0 | 26 | 376.625 | 8 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Melting_Point | 168-170? | Alfa-Aesar |
Melting_Point | 168-170° | Alfa-Aesar |
PUBCHEM_PATENT_ID | US4799774; US4871470; US5188758 | IBM Patent Data |