UCSF

ZINC02574321

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 13 Yes

Popular Name: 3-(2,6-Dichlorophenyl)propionic acid 3-(2,6-Dichlorophenyl)propionic …

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CAS Numbers: 51656-68-9 , [51656-68-9]

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) 3.14 0.84 -48.53 0 2 -1 40 218.059 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
MP 95-97° Matrix Scientific
Melting_Point 97-99? Alfa-Aesar
Melting_Point 97-99° Alfa-Aesar
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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