UCSF

ZINC05828461

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 2006 8 No

Popular Name: 2,4-hexadienoic acid 2,4-hexadienoic acid

Find On: PubMed — Wikipedia — Google

CAS Numbers: 110-44-1 , 24634-61-5 , 7492-55-9 , 7757-81-5

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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) 0.97 3.64 -50.05 0 2 -1 40 111.12 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5063747 IBM Patent Data

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