3-Methoxybenzaldehyde
Synonym(s):3-Methoxybenzaldehyde;m-Anisaldehyde
- CAS NO.：591-31-1
- Empirical Formula: C8H8O2
- Molecular Weight: 136.15
- MDL number: MFCD00003361
- EINECS: 209-712-8
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-12-18 14:15:32
What is 3-Methoxybenzaldehyde?
Chemical properties
clear pale yellow to yellow liquid
The Uses of 3-Methoxybenzaldehyde
3-Methoxybenzaldehyde is used to prepare 3-(3-methoxy-phenyl)-1-phenyl-propenone by reaction with benzldehyde. It is used as an eluent for mono-13C isotopomers of vanillin in normal phase silica gel chromatography. It acts as an inhibitor of 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone (NNK) metabolism.
Definition
ChEBI: 3-methoxybenzaldehyde is a member of the class of benzaldehydes in which the hydrogen at position 3 of benzaldehyde has been replaced by a methoxy group. It has a role as a Brassica napus metabolite. It is a member of benzaldehydes and a monomethoxybenzene.
Synthesis Reference(s)
Synthetic Communications, 24, p. 2011, 1994 DOI: 10.1080/00397919408010209
General Description
m-Anisaldehyde has significant antifungal activity against Candida sp., including the azole-resistant strains.
Safety Profile
Mutation data reported. Whenheated to decomposition it emits acrid smoke andirritating vapors.
Purification Methods
Wash it with saturated aqueous NaHCO3, then H2O, dry it with anhydrous MgSO4 and distil it under reduced pressure under N2. Store it under N2 in sealed glass ampoules. [Beilstein 8 IV 241.]
Properties of 3-Methoxybenzaldehyde
| Melting point: | 187 °C |
| Boiling point: | 143 °C50 mm Hg(lit.) |
| Density | 1.117 g/mL at 20 °C(lit.) |
| vapor pressure | 1.3 hPa (73 °C) |
| refractive index | n |
| Flash point: | >230 °F |
| storage temp. | Store below +30°C. |
| solubility | Chloroform, Methanol (Slightly) |
| form | Liquid |
| Specific Gravity | 1.118 |
| color | Clear pale yellow to yellow |
| Odor | at 100.00?%. anisic |
| Water Solubility | insoluble |
| Sensitive | Air Sensitive |
| BRN | 606013 |
| CAS DataBase Reference | 591-31-1(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzaldehyde, 3-methoxy-(591-31-1) |
| EPA Substance Registry System | Benzaldehyde, 3-methoxy- (591-31-1) |
Safety information for 3-Methoxybenzaldehyde
| 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 |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 3-Methoxybenzaldehyde
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