UCSF

ZINC34452428

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 18 No

Popular Name: 7,8-dinitrotetralin-6-carbonitrile 7,8-dinitrotetralin-6-carbonitrile

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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) 2.65 9.08 -14.07 0 7 0 115 247.21 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0283959A1; EP0283959B1; US4889855; US4912108 IBM Patent Data

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