UCSF

ZINC02560446

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 16 No

Popular Name: 4-Phenoxyphenyl isocyanate 4-Phenoxyphenyl isocyanate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 59377-19-4 , [59377-19-4]

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) 3.52 1.72 -3.94 0 3 0 38 211.22 3 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 169-170?/3mm Alfa-Aesar
Boiling_Point 169-170°/3mm Alfa-Aesar

Activity (Go SEA)

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