UCSF

ZINC00081682

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 No

Popular Name: 2-[(2-chloro-6-fluorobenzyl)oxy]benzaldehyde 2-[(2-chloro-6-fluorobenzyl)oxy]…

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CAS Numbers: 336880-01-4 , [336880-01-4]

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) 4.08 3.05 -11.9 0 2 0 26 264.683 4 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 7.100000000000000e+001 - 7.300000000000000e+001 KeyOrganics
melting_point 71 - 73 KeyOrganics
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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