UCSF

ZINC01732442

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 13 Yes

Popular Name: 4-Chlorophenethyl acetate 4-Chlorophenethyl acetate

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CAS Number: 59163-72-3

Other Names:

MFCD12964343

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) 2.87 2.33 -6.68 0 2 0 26 198.649 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem
PUBCHEM_PATENT_ID EP0457318A1; EP0457318B1; US5173497 IBM Patent Data

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