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Merck

146455

Isovaleraldehyde

97%

Sinónimos:

3-Methylbutanal, 3-Methylbutyraldehyde, NSC 404119

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Fórmula lineal:
(CH3)2CHCH2CHO
Número CAS:
Peso molecular:
86.13
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
209-691-5
Beilstein/REAXYS Number:
773692
MDL number:
Assay:
97%
Form:
liquid
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vapor density

2.96 (vs air)

Quality Level

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

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.


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Danger

Hazard Classifications

Aquatic Chronic 2 - Eye Irrit. 2 - Flam. Liq. 2 - Skin Sens. 1 - STOT SE 3

target_organs

Respiratory system

Clase de almacenamiento

3 - Flammable liquids

wgk

WGK 2

flash_point_f

32.9 °F - closed cup

flash_point_c

0.5 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter



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Analysis for wine C5-C8 aldehydes through the determination of their O-(2, 3, 4, 5, 6-pentafluorobenzyl) oximes formed directly in the solid phase extraction cartridge.
Cullere L, et al.
Analytica Chimica Acta, 524(1), 201-206 (2004)
Continuous production and in situ extraction of isovaleraldehyde in a membrane bioreactor
Molinari F, et al.
Immobilized Cells: Basics and Applications, 11, 538-545 (1996)
Microbial community and metabolite dynamics during soy sauce koji making
Tan G, et al.
Frontiers in Microbiology, 13, 841529-841529 (2022)