UCSF

ZINC03875586

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2005 24 Yes

Popular Name: Di-n-hexyl phthalate Di-n-hexyl phthalate

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CAS Number: 84-75-3

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) 6.45 4.23 -12.27 0 4 0 52 334.456 14 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 185-187?/0.5mm Alfa-Aesar
Boiling_Point 185-187°/0.5mm Alfa-Aesar
BP 333 TCI

Activity (Go SEA)

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