UCSF

ZINC02579815

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 20 Yes

Popular Name: 3,4,5-Triethoxybenzoylacetonitrile 3,4,5-Triethoxybenzoylacetonitrile

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CAS Number: 267880-91-1

Other Names:

MFCD02260819

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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) 1.68 7.4 -18.95 0 5 0 69 277.32 8 ↓

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