UCSF

ZINC02598066

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2004 10 Yes

Popular Name: 1-(2-Fluorophenyl)ethanol 1-(2-Fluorophenyl)ethanol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 162427-79-4 , 171032-87-4 , 20044-46-6 , 445-26-1 , 50919-06-7 , [171032-87-4] , [445-26-1]

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) 1.62 2.76 -4.13 1 1 0 20 140.157 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 110°/135mm Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 97% Matrix Scientific
PUBCHEM_PATENT_ID EP0244786A1 IBM Patent Data
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )