UCSF

ZINC02379683

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 13 No

Popular Name: 1-Isopropoxy-4-nitrobenzene 1-Isopropoxy-4-nitrobenzene

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CAS Numbers: 26455-31-2 , [26455-31-2]

Other Names:

MFCD01327671

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) 2.69 2.04 -5.9 0 4 0 55 181.191 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0232776A2; EP0365678A1; EP0365678B1; EP0389162A1; EP0389162B1; US4775692; US5086071; US5401768 IBM Patent Data

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