UCSF

ZINC00395545

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 11 Yes

Popular Name: 2,4-Dichlorophenethyl alcohol 2,4-Dichlorophenethyl alcohol

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CAS Numbers: 81156-68-5 , [81156-68-5]

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) 2.77 -1.52 -3.5 1 1 0 20 191.057 2 ↓

Vendor Notes

Note Type Comments Provided By
BP [°C] 119 (p=0.8 torr) Acros Organics
Boiling_Point 119?/0.8mm lit. Alfa-Aesar
Purity 95% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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