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ChemicalBook--->CAS DataBase List--->2011-06-5

2011-06-5

2011-06-5 Structure

2011-06-5 Structure
IdentificationBack Directory
[Name]

2-(BENZYLOXY)-3-METHOXYBENZALDEHYDE
[CAS]

2011-06-5
[Synonyms]

AKOS B004238
OTAVA-BB BB7018802006
2-BENZYLOXY-3-METHYLBENZALDEHYDE
3-Methoxy-2-(benzyloxy)benzaldehyde
2-(BENZYLOXY)-3-METHOXYBENZALDEHYDE
2-Benzyloxy-3-methoxybenzaldehyde,98%
3-methoxy-2-(phenylmethoxy)benzaldehyde
2-(BENZYLOXY)-3-METHOXYBENZENECARBALDEHYDE
[Molecular Formula]

C15H14O3
[MDL Number]

MFCD00202674
[MOL File]

2011-06-5.mol
[Molecular Weight]

242.27
Chemical PropertiesBack Directory
[Appearance]

Off-white to light yellow crystalline powder
[Melting point ]

44-46 °C(lit.)
[Boiling point ]

190-195 °C(Press: 3 Torr)
[density ]

1.154±0.06 g/cm3(Predicted)
[form ]

solid
[CAS DataBase Reference]

2011-06-5
Hazard InformationBack Directory
[Chemical Properties]

Off-white to light yellow crystalline powder
[General Description]

2-Benzyloxy-3-methoxybenzaldehyde (benzyl-o-vanillin) can be prepared from the reaction of o-vanillin with benzyl bromide in acetone (solvent) and K2CO3 (base) in the presence of tetra-n-butylammonium iodide (catalyst). The dihedral angle between the two benzene rings in 2-benzyloxy-3-methoxybenzaldehyde crystal is 23.33 (6)°. Crystal structure suggests that all O atoms are involved in intra and intermolecular C-HO interactions. It has been reported as key reagent for the synthesis of new anticancer drugs. It is an important pharmacophore in drug discovery. It exhibits anti-proliferative activity in HL60 leukemia cancer cells.
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H335-H319
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
[Hazard Codes ]

Xi
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

29124900
Spectrum DetailBack Directory
[Spectrum Detail]

2-(BENZYLOXY)-3-METHOXYBENZALDEHYDE(2011-06-5)IR
2-(BENZYLOXY)-3-METHOXYBENZALDEHYDE(2011-06-5)FT-IR
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