UCSF

ZINC03243304

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 18 Yes

Popular Name: 2-((4-Chlorobenzyl)oxy)benzoic acid 2-((4-Chlorobenzyl)oxy)benzoic acid

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CAS Numbers: 52803-69-7 , [52803-69-7]

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) 4.21 1.28 -57.68 0 3 -1 49 261.684 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 85 - 87 Enamine Building Blocks
MP 85...87 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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