UCSF

ZINC02169138

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 18 No

Popular Name: 3-[3,5-Bis(trifluoromethyl)phenyl]acrylonitrile 3-[3,5-Bis(trifluoromethyl)pheny…

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CAS Numbers: 175136-63-7 , [175136-63-7]

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) 4.17 7.36 -8.01 0 1 0 23 265.156 3 ↓

Vendor Notes

Note Type Comments Provided By
MP 80° Matrix Scientific
Purity 98% Fluorochem
Warnings Irritant Matrix Scientific

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