UCSF

ZINC08019367

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 28th, 2006 13 Yes

Popular Name: 3-(2-Chloro-6-fluorophenyl)propanoic acid 3-(2-Chloro-6-fluorophenyl)propa…

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CAS Numbers: 88740-77-6 , [88740-77-6]

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) 2.63 1.68 -49.67 0 2 -1 40 201.604 3 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 59-63? Alfa-Aesar
Melting_Point 59-63° Alfa-Aesar

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