UCSF

ZINC00119353

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 16 No

Popular Name: 4-Benzyloxybenzaldehyde 4-Benzyloxybenzaldehyde

Find On: PubMed — Wikipedia — Google

CAS Numbers: 151896-98-9 , 4397-53-9 , [4397-53-9]

Download: MOL2 SDF SMILES Flexibase

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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) 3.38 1.8 -8.77 0 2 0 26 212.248 4 ↓

Vendor Notes

Note Type Comments Provided By
BP [°C] 197 - 199 (p=11 torr) Acros Organics
Boiling_Point 197-199?/20mm Alfa-Aesar
Boiling_Point 197-199°/20mm Alfa-Aesar
BP 219 / 13 TCI
Melting_Point 69-74? Alfa-Aesar
Melting_Point 69-74° Alfa-Aesar
Mp [°C] 70 - 74 Acros Organics
M.P 71-74 °C Indofine
MP 72-74° Fluorochem
MP 73 - 74 Enamine Building Blocks
MP 73...74 Enamine Building Blocks
MP 74 TCI
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

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