UCSF

ZINC00397506

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 13 Yes

Popular Name: Ethyl phenoxyacetate Ethyl phenoxyacetate

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CAS Numbers: 2555-49-9 , [2555-49-9]

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) 2.23 2.37 -8.2 0 3 0 35 180.203 5 ↓

Vendor Notes

Note Type Comments Provided By
BP [°C] 136 (p=19 torr) Acros Organics
BP 136°/19mm Fluorochem
Boiling_Point 251-253? Alfa-Aesar
Boiling_Point 251-253° Alfa-Aesar
Purity 99% Matrix Scientific
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )