UCSF

ZINC16159342

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2008 10 Yes

Popular Name: 2-Amino-4-fluorobenzonitrile 2-Amino-4-fluorobenzonitrile

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CAS Number: 80517-22-2

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) 1.27 2.82 -4.61 2 2 0 50 136.129 0 ↓

Vendor Notes

Note Type Comments Provided By
MP 111-111.5° Matrix Scientific
Purity 97% Fluorochem
Purity 98% Matrix Scientific
Warnings TOXIC Matrix Scientific

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