UCSF

ZINC03883624

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 15 Yes

Popular Name: 1-[5-(4-fluorophenyl)-2-thienyl]-1-ethanone 1-[5-(4-fluorophenyl)-2-thienyl]…

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CAS Numbers: 886361-46-2 , [886361-46-2]

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) 3.82 1.82 -6.7 0 1 0 17 220.268 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 119 - 120 KeyOrganics
MP 119-120° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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