UCSF

ZINC00164135

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 12 Yes

Popular Name: 2,4-Dimethoxybenzyl alcohol 2,4-Dimethoxybenzyl alcohol

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CAS Numbers: 7314-44-5 , [7314-44-5]

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) 1.32 0.63 -5.81 1 3 0 39 168.192 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 135 / 2 TCI
BP [°C] 177 - 179 (p=10 torr) Acros Organics
Boiling_Point 177-179?/10mm Alfa-Aesar
BP 177-179°/10 mm Oakwood Chemical
Boiling_Point 177-179°/10mm Alfa-Aesar
Melting_Point 35-39? Alfa-Aesar
Melting_Point 35-39° Alfa-Aesar
MP 36 TCI
Mp [°C] 37 - 40 Acros Organics
M.P 38-40 °C Indofine
MP 38-40° Oakwood Chemical
Purity 95% Fluorochem
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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