UCSF

ZINC02566090

Draw Identity 99% 90% 80% 70%

Substance Information

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

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

Find On: PubMed — Wikipedia — Google

CAS Numbers: 70547-87-4 , [70547-87-4]

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) 2.00 2.61 -6.82 1 2 0 37 150.177 1 ↓

Vendor Notes

Note Type Comments Provided By
M.P 190-196°C Indofine
MP 193-195° Matrix Scientific
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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