UCSF

ZINC00388155

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 15 Yes

Popular Name: 4-Chlorobenzhydrol 4-Chlorobenzhydrol

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CAS Numbers: 119-56-2 , [119-56-2]

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) 3.54 -0.67 -4.68 1 1 0 20 218.683 2 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 150-151?/2.6mm Alfa-Aesar
Boiling_Point 150-151°/2.6mm Alfa-Aesar
MP 58 - 60 Enamine Building Blocks
Melting_Point 58-62? Alfa-Aesar
Melting_Point 58-62° Alfa-Aesar
MP 58...60 Enamine Building Blocks
MP 61 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem

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