UCSF

ZINC02525029

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 11 No

Popular Name: 4-Hydroxy-2,5-dimethylbenzaldehyde 4-Hydroxy-2,5-dimethylbenzaldehyde

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CAS Numbers: 85231-15-8 , [85231-15-8]

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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) 2.47 2.72 -10.65 1 2 0 37 150.177 1 ↓
Hi High (pH 8-9.5) 2.47 3.51 -42.84 0 2 -1 40 149.169 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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