UCSF

ZINC02566019

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 11 No

Popular Name: 2,4-Dichloro-6-hydroxybenzaldehyde 2,4-Dichloro-6-hydroxybenzaldehyde

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CAS Numbers: 78443-72-8 , [78443-72-8]

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) 2.93 -0.53 -6.83 1 2 0 37 191.013 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 50-53? Alfa-Aesar
Melting_Point 50-53° Alfa-Aesar
MP 51-53° Matrix Scientific
Purity 97% Matrix Scientific
Purity 98% Matrix Scientific
Warnings IRRITANT, AIR SENSITIVE Matrix Scientific
Warnings Irritant/Air Sensitive Matrix Scientific

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.