UCSF

ZINC19262415

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 13 No

Popular Name: 3-Cyanocinnamic acid 3-Cyanocinnamic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 16642-93-6 , 32858-79-0 , [16642-93-6]

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) 1.64 5.75 -49.5 0 3 -1 64 172.163 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 246 - 248 Enamine Building Blocks
MP 246...248 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem

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