UCSF

ZINC02600089

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2004 13 No

Popular Name: 2-FLUORO-3-(TRIFLUOROMETHYL)BENZYL BROMIDE 2-FLUORO-3-(TRIFLUOROMETHYL)BENZ…

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CAS Number: 184970-25-0

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) 3.61 6.91 -5.84 0 0 0 0 257.024 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 47-49? Alfa-Aesar
MP 47-49° Matrix Scientific
Purity 98% Matrix Scientific
Warnings Corrosive/Lachrymator Matrix Scientific
Warnings LACHRYMATOR, CORROSIVE Matrix Scientific

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

No pre-computed analogs available. Try a structural similarity search.