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Merck

55624

Sigma-Aldrich

3-羟基-3-甲基丁腈

≥97.0% (GC)

别名:

β-羟基异戊腈

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About This Item

线性分子式:
HOC(CH3)2CH2CN
CAS号:
分子量:
99.13
Beilstein:
1738209
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22

化驗

≥97.0% (GC)

折射率

n20/D 1.430

bp

114-116 °C/30 mmHg (lit.)

密度

0.959 g/mL at 20 °C (lit.)

儲存溫度

2-8°C

SMILES 字串

CC(C)(O)CC#N

InChI

1S/C5H9NO/c1-5(2,7)3-4-6/h7H,3H2,1-2H3

InChI 密鑰

CWPMDJFBWQJRGT-UHFFFAOYSA-N

一般說明

3-Hydroxy-3-methylbutyronitrile is a β-hydroxynitrile. It undergoes thermal degradation in gas phase via a six-membered cyclic transition state. 3-Hydroxy-3-methylbutyronitrile can be synthesized from 2-hydroxy-2-methyl-1-bromopropane.

應用

3-Hydroxy-3-methylbutyronitrile may be used to synthesize 1,1-dimethylcyanoethyl bromoacetate.

象形圖

Exclamation mark

訊號詞

Warning

危險聲明

危險分類

Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

儲存類別代碼

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

水污染物質分類(WGK)

WGK 3

閃點(°F)

206.6 °F - closed cup

閃點(°C)

97 °C - closed cup

個人防護裝備

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


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Elimination kinetics of β-hydroxynitriles in the gas phase.
Chuchani G, et al.
Journal of Physical Organic Chemistry, 12, 19-23 (1999)
Theoretical study of the thermolysis reaction of β-hydroxynitriles in the gas phase.
Chamorro E, et al.
International Journal of Quantum Chemistry, 91(5), 618-625 (2003)
Douglas J Dellinger et al.
Journal of the American Chemical Society, 125(4), 940-950 (2003-01-23)
Phosphonoacetate and thiophosphonoacetate oligodeoxynucleotides were prepared via a solid-phase synthesis strategy. Under Reformatsky reaction conditions, novel esterified acetic acid phosphinodiamidites were synthesized and condensed with appropriately protected 5'-O-(4, 4'-dimethoxytrityl)-2'-deoxynucleosides to yield 3'-O-phosphinoamidite reactive monomers. These synthons when activated with tetrazole

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