UCSF

ZINC02040376

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2004 14 Yes

Popular Name: Ethyl trans-4-decenoate Ethyl trans-4-decenoate

Find On: PubMed — Wikipedia — Google

CAS Number: 76649-16-6

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) 4.23 3.31 -4.24 0 2 0 26 198.306 9 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US3953377 IBM Patent Data

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