UCSF

ZINC12359520

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 13 Yes

Popular Name: 1-Boc-3-cyanoazetidine 1-Boc-3-cyanoazetidine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 142253-54-1 , [142253-54-1]

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) 1.39 4.25 -15.71 0 4 0 53 182.223 2 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 70-71? Alfa-Aesar
Melting_Point 70-71° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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