UCSF

ZINC04352626

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2005 13 Yes

Popular Name: Ethyl 2-phenylpropanoate Ethyl 2-phenylpropanoate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 111170-56-0 , 2510-99-8

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) 2.51 2.79 -5.65 0 2 0 26 178.231 4 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Fluorochem
PUBCHEM_PATENT_ID US4818749 IBM Patent Data

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