UCSF

ZINC59171957

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 26th, 2011 12 No

Popular Name: 1-(Difluoromethyl)-2-nitrobenzene 1-(Difluoromethyl)-2-nitrobenzene

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CAS Numbers: 64747-65-5 , [64747-65-5]

Other Names:

MFCD23382510

N/A

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) 2.39 5.88 -13.52 0 3 0 46 173.118 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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