UCSF

ZINC00058257

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 13 Yes

Popular Name: Ethyl 3-phenylpropionate Ethyl 3-phenylpropionate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 2021-28-5 , [2021-28-5]

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) 2.56 2.59 -5 0 2 0 26 178.231 5 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 118?/3mm Alfa-Aesar
Boiling_Point 118°/3mm Alfa-Aesar
BP 248 TCI
Purity 95% Fluorochem
PUBCHEM_PATENT_ID EP0713149B1 IBM Patent Data

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