UCSF

ZINC02547826

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 5 Yes

Popular Name: 3-Fluoroazetidine hydrochloride 3-Fluoroazetidine hydrochloride

Find On: PubMed — Wikipedia — Google

CAS Numbers: 617718-46- , 617718-46-4 , 690257-76-2 , [617718-46-4] , [690257-76-2]

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) 0.24 0.76 -39.66 2 1 1 17 76.094 0 ↓
Mid Mid (pH 6-8) 0.24 -0.88 -2.76 1 1 0 12 75.086 0 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 59? Alfa-Aesar
Boiling_Point 59° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Matrix Scientific
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Refrigerate Matrix Scientific

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

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