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Merck

W222011

Sigma-Aldrich

异丁醛

greener alternative

natural, 96%, FG

别名:

2-甲基丙醛

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About This Item

线性分子式:
(CH3)2CHCHO
CAS号:
分子量:
72.11
FEMA號碼:
2220
Beilstein:
605330
EC號碼:
歐洲委員會號碼:
92c
MDL號碼:
分類程式碼代碼:
12164502
PubChem物質ID:
Flavis號碼:
5.004
NACRES:
NA.21
agency:
follows IFRA guidelines

等級

FG
Fragrance grade
Halal
Kosher
natural

品質等級

agency

follows IFRA guidelines

法律遵循

EU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002
FDA 21 CFR 117

蒸汽密度

2.5 (vs air)

蒸汽壓力

66 mmHg ( 4.4 °C)

化驗

96%

自燃溫度

384 °F

expl. lim.

10 %, 25 °F
2 %, 32 °F

環保替代產品特色

Less Hazardous Chemical Syntheses
Use of Renewable Feedstocks
Learn more about the Principles of Green Chemistry.

折射率

n20/D 1.374 (lit.)

bp

63 °C (lit.)

mp

−65 °C (lit.)

溶解度

60 g/L at 25 °C

密度

0.79 g/mL at 25 °C (lit.)

應用

flavors and fragrances

文件

see Safety & Documentation for available documents

食物過敏原

no known allergens

香料過敏原

no known allergens

環保替代類別

感官的

cocoa; pungent; brown

SMILES 字串

[H]C(=O)C(C)C

InChI

1S/C4H8O/c1-4(2)3-5/h3-4H,1-2H3

InChI 密鑰

AMIMRNSIRUDHCM-UHFFFAOYSA-N

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一般說明

We are committed to bringing you Greener Alternative Products, which adhere to one of the four categories of Greener Alternatives . This product is a Biobased products, showing key improvements in Green Chemistry Principles “Less Hazardous Chemical Syntheses” and “Use of Renewable Feedstock”.

應用


  • Efficient total synthesis of pulchellalactam, a CD45 protein tyrosine phosphatase inhibitor.: Discusses a synthetic route involving isobutyraldehyde for developing inhibitors that have potential applications in biochemistry and medical research (Li WR et al., 2002).

象形圖

FlameExclamation mark

訊號詞

Danger

危險聲明

危險分類

Eye Irrit. 2 - Flam. Liq. 2

儲存類別代碼

3 - Flammable liquids

水污染物質分類(WGK)

WGK 1

閃點(°F)

-11.2 °F - closed cup

閃點(°C)

-24 °C - closed cup

個人防護裝備

Eyeshields, Faceshields, Gloves


历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Christine Counet et al.
Journal of agricultural and food chemistry, 50(8), 2385-2391 (2002-04-04)
After vacuum distillation and liquid-liquid extraction, the volatile fractions of dark chocolates were analyzed by gas chromatography-olfactometry and gas chromatography-mass spectrometry. Aroma extract dilution analysis revealed the presence of 33 potent odorants in the neutral/basic fraction. Three of these had
Rudy Coquet et al.
Physical chemistry chemical physics : PCCP, 9(45), 6040-6046 (2007-11-16)
The formation and catalytic behavior of active structures in a SiO(2)-supported unsaturated Ru complex catalyst for alkene epoxidation were studied by means of hybrid density functional theory (DFT) calculations. An energy-gaining route for the catalyst activation was found to allow
Organocatalytic enantioselective cross-aldol reactions of aldehydes with isatins: formation of two contiguous quaternary centered 3-substituted 3-hydroxyindol-2-ones.
Fei Xue et al.
Chemistry, an Asian journal, 4(11), 1664-1667 (2009-09-12)
S Bahmanyar et al.
Journal of the American Chemical Society, 125(9), 2475-2479 (2003-02-27)
Quantum mechanical calculations were employed to predict the ratio of four stereoisomeric products expected from two complex reactions involving the aldol reactions of cyclohexanone with benzaldehyde or with isobutyraldehyde catalyzed by (S)-proline. Experimental tests of these predictions provide an assessment
Hamid Reza Khavasi et al.
Inorganic chemistry, 48(13), 5593-5595 (2009-05-28)
Dioxygen epoxidation of cyclic alkenes into their corresponding epoxides was successfully achieved in good yield by using a novel binuclear manganese carboxamide complex as the catalyst and isobutyraldehyde as the cosubstrate.

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