所有图片(1)
About This Item
经验公式（希尔记法）:
C3H5ClO
CAS号:
分子量:
92.52
Beilstein:
1420784
MDL编号:
UNSPSC代码:
12352005
PubChem化学物质编号:
NACRES:
NA.22
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蒸汽密度
3.2 (vs air)
质量水平
蒸汽压
12.5 mmHg ( 20 °C)
方案
98%
旋光性
[α]20/D +35°, c = 1 in methanol
光学纯度
ee: 97% (GLC)
自燃温度
1421 °F
expl. lim.
21 %
折射率
n20/D 1.438 (lit.)
沸点
92-93 °C/360 mmHg (lit.)
密度
1.183 g/mL at 25 °C (lit.)
官能团
chloro
ether
SMILES字符串
ClC[C@@H]1CO1
InChI
1S/C3H5ClO/c4-1-3-2-5-3/h3H,1-2H2/t3-/m1/s1
InChI key
BRLQWZUYTZBJKN-GSVOUGTGSA-N
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应用
作为潜在的代谢调节剂，用以合成脂肪酸氧化抑制剂。
用于 Macquarimicins 的全合成和大环内酯 RK-397 的全合成。
用于对映选择性合成羟基异噁唑烷和 (+)-顺式-sylvaticin（一种有潜力的抗肿瘤剂）的手性结构单元。
法律信息
经Sterling Pharma Solutions Limited许可，使用Jacobsen HKR技术制造。
警示用语：
Danger
危险分类
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Carc. 1B - Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1B - Skin Sens. 1
储存分类代码
3 - Flammable liquids
WGK
WGK 3
闪点(°F)
89.6 °F - closed cup
闪点(°C)
32 °C - closed cup
个人防护装备
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
法规信息
危险化学品
Ryosuke Munakata et al.
Journal of the American Chemical Society, 125(48), 14722-14723 (2003-12-04)
The first total synthesis of (+)-macquarimicin A (1), a novel inhibitor of neutral sphingomyelinase (N-SMase) with antiinflammatory activity, has been accomplished. The present work determined the absolute configuration of (+)-1 and revised the C(2)-C(3) geometry to be Z. The synthesis
Tetrahedron Letters, 47, 7635-7635 (2006)
Elfatih Elzein et al.
Bioorganic & medicinal chemistry letters, 14(4), 973-977 (2004-03-12)
We describe the synthesis of novel inhibitors of fatty acid oxidation as potential metabolic modulators for the treatment of stable angina. Replacement of the 2H-benzo[d]1,3-dioxolene ring system in our initial lead 3 with different benzthiazoles, benzoxazoles and introducing small alkyl
Svetlana A Burova et al.
Journal of the American Chemical Society, 126(8), 2495-2500 (2004-02-26)
The total synthesis of the natural product RK-397 is based on a new synthetic strategy for assembling polyacetate structures, by efficient cross-coupling of nucleophilic terminal alkyne modules with electrophilic epoxides bearing another alkyne at the opposite terminus. The natural product
Ryosuke Munakata et al.
Journal of the American Chemical Society, 126(36), 11254-11267 (2004-09-10)
A total synthesis of the macquarimicins A-C (1-3), novel natural products with intriguing tetra- or pentacyclic frameworks, has been achieved. The synthesis features an extensive investigation of the biosynthesis-based intramolecular Diels-Alder (IMDA) reactions of (E,Z,E)-1,6,8-nonatrienes. Considering possible biosynthetic sequences, four
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