4-(Benzyloxy)benzaldehyde

Basic Information

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CAS Number

4397-53-9

Molecular Formula

C14H12O2

Molecular Weight

212.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

71-74 °C

Boiling Point

219°C/13mmHg

Flash Point

197-199℃/20mm

Refractive Index

1.6000 (estimate)

SMILES

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C1=CC=C(C=C1)COC2=CC=C(C=C2)C=O

InChI

InChI=1S/C14H12O2/c15-10-12-6-8-14(9-7-12)16-11-13-4-2-1-3-5-13/h1-10H,11H2

InChIKey

ZVTWZSXLLMNMQC-UHFFFAOYSA-N

LogP

3.078100000000002

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

201

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Sensitiveness

Air Sensitive

Synonyms & References

English

5570-82-1
4-benzoxybenzaldehyde
4-Benzyloxy-benzaldehyde
NS00031380
BB 0243317
p-benzyloxybenzaldehyde
MFCD00003387
Q63396607
SCHEMBL158270
StratoSpheres(TM) PL-CHO (Benzaldehyde) resin, 50-100 mesh, extent of labeling: 3.0 mmol/g loading, 1 % cross-linked
4-(phenylmethoxybenzaldehyde
NSC-28298
151896-98-9
A826467
NSC28298
4-(Benzyloxy)benzaldehyde, 97%
Z26334962
FT-0617661
4-(benzyloxy)-benzaldehyde
4-(Benzyloxy)benzaldehyde, Vetec(TM) reagent grade, 97%
12P-070
2,4,5-trifluoropropiophenone
4397-53-9
NSC131669
4-formylphenoxy phenyl methane
Benzaldehyde, 4-(phenylmethoxy)-
4-Benzyloxybenzaldehyde
p-(Benzyloxy)benzaldehyde
NSC 28298
4benzyloxybenzaldehyde
CBMicro_014912

MDL Number

MFCD00003387

Customs Code

29124900

FAQ

What are the physical and chemical properties of 4-(Benzyloxy)benzaldehyde (CAS: 4397-53-9)?

4-(Benzyloxy)benzaldehyde (CAS: 4397-53-9) is a white solid with a molecular weight of 228.23 g/mol. It has a highly polar nature and is sparingly soluble in water but soluble in organic solvents like ethanol and acetone. Chemically, it is moderately reactive, especially towards nucleophilic substitution reactions. It is often used as a substrate in organic synthesis due to its reactivity and stability.

How is 4-(Benzyloxy)benzaldehyde (CAS: 4397-53-9) typically synthesized?

4-(Benzyloxy)benzaldehyde (CAS: 4397-53-9) is typically synthesized by reacting benzoic acid with benzyl alcohol in the presence of a Lewis acid catalyst like aluminum chloride. The reaction selectively forms the benzyl ether linkage, yielding a yield of up to 90%. The process involves careful temperature control and the use of a fume hood for safety.

What industries use 4-(Benzyloxy)benzaldehyde (CAS: 4397-53-9)?

4-(Benzyloxy)benzaldehyde (CAS: 4397-53-9) is primarily used in the pharmaceutical industry for the synthesis of various drugs, as well as in the polymer industry for the production of functional polymers with improved properties. It also finds applications in sensors and semiconductors due to its unique chemical functionalities.

What precautions should be taken when handling 4-(Benzyloxy)benzaldehyde (CAS: 4397-53-9)?

When handling 4-(Benzyloxy)benzaldehyde (CAS: 4397-53-9), it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to prevent inhalation. Spills should be immediately contained and cleaned up using appropriate techniques. Always consult the Safety Data Sheet (SDS) for detailed handling and emergency procedures.