UCSF

ZINC08781987

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2007 19 No

Popular Name: 2-(2-nitrophenoxy)-1-phenyl-1-ethanone 2-(2-nitrophenoxy)-1-phenyl-1-et…

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CAS Number: 18065-01-5

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) 3.05 9.88 -22.02 0 5 0 72 257.245 5 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 118 - 120 KeyOrganics
PUBCHEM_PATENT_ID US4988662 IBM Patent Data

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