146455

Isovaleraldehyde

97%

• Synonym(s): 3-Methylbutanal, 3-Methylbutyraldehyde, NSC 404119
• Linear Formula: (CH₃)₂CHCH₂CHO
• CAS Number: 590-86-3
• Molecular Weight: 86.13
• Beilstein: 773692
• EC Number: 209-691-5
• MDL number: MFCD00007014
• UNSPSC Code: 12352100
• PubChem Substance ID: 24848781
• NACRES: NA.22

Properties

• vapor density: 2.96 (vs air)
• Quality Level: 100
• vapor pressure: 30 mmHg ( 20 °C)
• Assay: 97%
• form: liquid
• autoignition temp.: 464 °F
• refractive index: n20/D 1.388 (lit.)
• bp: 90 °C (lit.)
• solubility: alcohol: miscible; diethyl ether: miscible; water: slightly soluble
• density: 0.803 g/mL at 25 °C (lit.)
• functional group: aldehyde
• Organoleptic: pungent
• storage temp.: 2-8°C
• SMILES string: [H]C(=O)CC(C)C
• InChI: 1S/C5H10O/c1-5(2)3-4-6/h4-5H,3H2,1-2H3
• InChI key: YGHRJJRRZDOVPD-UHFFFAOYSA-N

Description

General description

Isovaleraldehyde is a short-chain aldehyde that can be produced by oxidizing isoamyl alcohol.

Isovaleraldehyde is an attractant and its interaction with zoospores of the fungus Phytophthora palmivora has been studied by binding techniques.

Application

Isovaleraldehyde was used as standard to evaluate the quality of olive oils by headspace solid-phase microextraction-gas chromatography using flame ionization detection and multivariate analysis. It was used as internal standard in determination of wine aroma carbonyl compounds with 5-8 carbon atoms.

Safety Information

• Pictograms: GHS02,GHS07,GHS09
• Signal Word: Danger
• Hazard Statements: H225,H317,H319,H335,H411
• Precautionary Statements: P210 - P233 - P273 - P280 - P303 + P361 + P353 - P305 + P351 + P338
• Hazard Classifications: Aquatic Chronic 2 - Eye Irrit. 2 - Flam. Liq. 2 - Skin Sens. 1 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 2
• Flash Point(F): 32.9 °F - closed cup
• Flash Point(C): 0.5 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves