UCSF

ZINC02531040

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 10 Yes

Popular Name: 3-Ethynylanisole 3-Ethynylanisole

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CAS Numbers: 768-70-7 , [768-70-7]

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) 1.73 4.98 -5.52 0 1 0 9 132.162 1 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 204-210? Alfa-Aesar
BP 204-210° Oakwood Chemical
Purity 96% Fluorochem

Activity (Go SEA)

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