UCSF

ZINC00155649

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 Yes

Popular Name: Cyclopropyl 4-fluorophenyl ketone Cyclopropyl 4-fluorophenyl ketone

Find On: PubMed — Wikipedia — Google

CAS Numbers: 772-31-6 , [772-31-6]

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) 2.49 2.19 -5.64 0 1 0 17 164.179 2 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 119-120?/13mm Alfa-Aesar
BP 119-120°/13mm Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 99% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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