BDBM36189 1-methylcyclohexanol
SMILES: CC1(O)CCCCC1
InChI Key: InChIKey=VTBOTOBFGSVRMA-UHFFFAOYSA-N
Data: 1 ITC
Cell (A) | Syringe (B) | Cell Links | Syringe Links | Cell + Syr Links | ΔG° kcal/mole | -TΔS° kcal/mole | ΔH° kcal/mole | log K | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|
BDBM11 | BDBM36189 | CHEBI KEGG MMDB PC cid PC sid PDB | CHEBI PC cid PC sid | -4.17 | -1.89 | -2.29 | 3.06 | 6.90 | 25 | |
NIST | J Phys Chem B 101: 87-100 (1997) |