UCSF

ZINC19472534

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 10 Yes

Popular Name: 3-(4-morpholino)propionitrile 3-(4-morpholino)propionitrile

Find On: PubMed — Wikipedia — Google

CAS Numbers: 4542-47-6 , 65876-26-8 , [4542-47-6] , [65876-26-8]

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) -0.35 0.99 -7.35 0 3 0 36 140.186 2 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 106-109?/7mm Alfa-Aesar
Boiling_Point 106-109°/7mm Alfa-Aesar
Melting_Point 20-21? Alfa-Aesar
Melting_Point 20-21° Alfa-Aesar
BP 246 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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