UCSF

ZINC04520668

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2005 15 Yes

Popular Name: 2-(4-Methoxyphenoxy)butanoic acid 2-(4-Methoxyphenoxy)butanoic acid

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CAS Numbers: , 67648-60-6

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) 2.16 1.31 -49.31 0 4 -1 58 209.221 5 ↓

Vendor Notes

Note Type Comments Provided By
BP 150-155°/1 Torr Matrix Scientific
MP 52° Matrix Scientific
PUBCHEM_PATENT_ID EP0036545A1; US4415494 IBM Patent Data
Warnings IRRITANT Matrix Scientific

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