UCSF

ZINC01845841

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 9 Yes

Popular Name: 1-PHENYL-1-PROPYNE 1-PHENYL-1-PROPYNE

Find On: PubMed — Wikipedia — Google

CAS Number: 673-32-5

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) 2.51 2.37 -4.57 0 0 0 0 116.163 0 ↓

Vendor Notes

Note Type Comments Provided By
BP 181 TCI
Boiling_Point 183-185? Alfa-Aesar
Boiling_Point 183-185° Alfa-Aesar
BP [°C] 185 Acros Organics
Purity 95% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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