3-Methyl-2-furoic acid
Synonym(s):3-Methylfuran-2-carboxylic acid
- CAS NO.:4412-96-8
- Empirical Formula: C6H6O3
- Molecular Weight: 126.11
- MDL number: MFCD00014111
- EINECS: 224-571-2
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-05-25 10:25:48
What is 3-Methyl-2-furoic acid?
Chemical properties
white to beige powder
The Uses of 3-Methyl-2-furoic acid
3-Methyl-2-furoic acid can be used in a palladium-catalyzed cross-coupling between heteroaryl carboxylic acids and aryl bromides leading to arylated heterocycles.1 Also used in a palladium-catalyzed asymmetric hydrogenation.
The Uses of 3-Methyl-2-furoic acid
Used in a palladium-catalyzed cross-coupling between heteroaryl carboxylic acids and aryl bromides leading to arylated heterocycles. Also used in a palladium-catalyzed asymmetric hydrogenation.
Definition
ChEBI: 3-Methyl-2-furoic acid is a furoic acid.
Properties of 3-Methyl-2-furoic acid
Melting point: | 134-138 °C |
Boiling point: | 174.21°C (rough estimate) |
Density | 1.2048 (rough estimate) |
refractive index | 1.4189 (estimate) |
storage temp. | 2-8°C |
solubility | soluble in Methanol |
pka | 3.45±0.20(Predicted) |
form | powder to crystal |
color | White to Almost white |
BRN | 116183 |
CAS DataBase Reference | 4412-96-8(CAS DataBase Reference) |
NIST Chemistry Reference | 3-Methyl-2-furoic acid(4412-96-8) |
Safety information for 3-Methyl-2-furoic acid
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-Methyl-2-furoic acid
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5-Methyl-2-furoic acid
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5-[(4-ethyl-2,3-dioxopiperazin-1-yl)methyl]-2-furoic acid
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METHYL 4-(CHLOROSULFONYL)-2,5-DIMETHYL-3-FUROATE
5-[(2,5-dioxoimidazolidin-1-yl)methyl]-2-furoic acid
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