4-Benzyloxybenzaldehyde
- CAS NO.：4397-53-9
- Empirical Formula: C14H12O2
- Molecular Weight: 212.24
- MDL number: MFCD00003387
- EINECS: 224-527-2
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-12-18 14:08:52
What is 4-Benzyloxybenzaldehyde?
Chemical properties
creamish to yellow crystalline powder
The Uses of 4-Benzyloxybenzaldehyde
4-Benzyloxybenzaldehyde is a position isomer of the adenylyl cyclase activator 2-Benzyloxybenzaldehyde. 4-Benzyloxybenzaldehyde also has much less potent anticancer activity against HL-60 cells that i ts isomeric counterpart.
The Uses of 4-Benzyloxybenzaldehyde
4-Benzyloxybenzaldehyde is used in the synthesis of (5-fluoro-(2R*,3S*)-2,3-bis(4-hydroxyphenyl)pentanenitrile),an estrogen receptor β-selective ligand. It is a position isomer of the adenylyl cyclase activator 2-benzyloxybenzaldehyde.
Synthesis Reference(s)
Journal of Medicinal Chemistry, 32, p. 192, 1989 DOI: 10.1021/jm00121a035
General Description
4-(Benzyloxy)benzaldehyde was used in the synthesis of (5-fluoro-(2R*,3S*)-2,3-bis(4-hydroxyphenyl)pentanenitrile),an estrogen receptor β-selective ligand.
Properties of 4-Benzyloxybenzaldehyde
| Melting point: | 71-74 °C (lit.) |
| Boiling point: | 197-199 °C (11 mmHg) |
| Density | 1.1035 (rough estimate) |
| refractive index | 1.6000 (estimate) |
| Flash point: | 197-199°C/20mm |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | Chloroform (Slightly), Ethyl Acetate (Sparingly) |
| form | Crystalline Powder |
| color | Creamish to yellow |
| Water Solubility | insoluble |
| Sensitive | Air Sensitive |
| BRN | 1242385 |
| CAS DataBase Reference | 4397-53-9(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzyl 4-formylphenyl ether(4397-53-9) |
| EPA Substance Registry System | Benzaldehyde, 4-(phenylmethoxy)- (4397-53-9) |
Safety information for 4-Benzyloxybenzaldehyde
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
Computed Descriptors for 4-Benzyloxybenzaldehyde
| InChIKey | ZVTWZSXLLMNMQC-UHFFFAOYSA-N |
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