UCSF

ZINC07603926

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 7th, 2006 18 Yes

Popular Name: 2-[(4-Bromobenzyl)oxy]benzoic acid 2-[(4-Bromobenzyl)oxy]benzoic acid

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CAS Numbers: 860597-33-7 , [860597-33-7]

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) 4.34 0.67 -57.59 0 3 -1 49 306.135 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 119 - 121 Enamine Building Blocks
MP 119...121 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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