UCSF

ZINC00404023

Draw Identity 99% 90% 80% 70%

Substance Information

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

Popular Name: Dimethyl 4-hydroxyisophthalate Dimethyl 4-hydroxyisophthalate

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CAS Numbers: 5985-24-0 , [5985-24-0]

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) 2.28 2.06 -9.91 1 5 0 72 210.185 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
MP 95-99° Oakwood Chemical
MP 97 TCI

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