UCSF

ZINC01589687

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 13 Yes

Popular Name: 1-Phenylcyclohexanol 1-Phenylcyclohexanol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1589-60-2 , [1589-60-2]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 3.25 -0.74 -3.03 1 1 0 20 176.259 1 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 153?/20mm Alfa-Aesar
Boiling_Point 153°/20mm Alfa-Aesar
Melting_Point 58-62? Alfa-Aesar
Melting_Point 58-62° Alfa-Aesar
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0094347A1; EP0243802A2; EP0243802B1; EP0718694A3; EP0934247A1; EP0960355A1; EP1044238A1; US4691058; US4877922; US5204379; US5280090; US5346771; US5352712; US5506051; US5516509; US5527835; US5536529; US5538791; US5587403; US5639846; US5770306; US5882792 IBM Patent Data

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