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Merck

168548

Sigma-Aldrich

1,3-二氯丙酮

≥95%

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About This Item

线性分子式:
ClCH2COCH2Cl
CAS号:
分子量:
126.97
EC號碼:
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22

蒸汽密度

4.38 (vs air)

品質等級

蒸汽壓力

<0.1 mmHg ( 20 °C)

化驗

≥95%

形狀

solid

bp

173 °C (lit.)

mp

39-41 °C (lit.)

溶解度

alcohol: very soluble
diethyl ether: very soluble
water: soluble

密度

1.383 g/mL at 25 °C (lit.)

官能基

chloro
ketone

儲存溫度

2-8°C

SMILES 字串

ClCC(=O)CCl

InChI

1S/C3H4Cl2O/c4-1-3(6)2-5/h1-2H2

InChI 密鑰

SUNMBRGCANLOEG-UHFFFAOYSA-N

一般說明

1,3-二氯丙酮已通过TLC被鉴定为1,3-二氯丙醇的代谢物。已通过分光光度对1,3-二氯丙酮在二恶烷和乙腈水溶液中的可逆水合反应的动力学进行了研究

1,3-二氯丙酮是一种二卤酮衍生物,可用于合成复杂的多环肽的试剂。

應用

1,3-二氯丙酮在与给体底物(如丙酮,环戊酮和环己酮)的交叉羟醛反应中用作受体底物

訊號詞

Danger

危險分類

Acute Tox. 1 Inhalation - Acute Tox. 2 Dermal - Acute Tox. 2 Oral - Muta. 2 - Skin Corr. 1B

儲存類別代碼

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

水污染物質分類(WGK)

WGK 3

閃點(°F)

Not applicable

閃點(°C)

Not applicable

個人防護裝備

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges


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分析证书(COA)

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Kinetics of the reversible hydration of 1, 3-dichloroacetone in dioxan and acetonitrile solution.
Bell RP, et al.
Proc. Royal Soc. Lond. B., 303(1472), 1-16 (1968)
Han Siean Lee et al.
Biomedicines, 8(10) (2020-10-18)
Relaxin-3 is a highly conserved two-chain neuropeptide that acts through its endogenous receptor the Relaxin Family Peptide-3 (RXFP3) receptor. The ligand/receptor system is known to modulate several physiological processes, with changes in food intake and anxiety-levels the most well studied
Ling Lu et al.
The Journal of organic chemistry, 64(3), 843-853 (2001-10-25)
Cross-aldol reactions of carbonyl compounds were achieved by the catalysis of SmI(2) or SmI(3), together with molecular sieves, at ambient temperature. 1,3-Dichloroacetone and 1-chloroacetone can be used as acceptor substrates in the cross-aldol reactions with donor substrates such as acetone
M Wojewodzka et al.
Chemico-biological interactions, 74(3), 221-231 (1990-01-01)
A number of polyamine (PA) derivatives of thiosemicarbazone of 1,3-dichloroacetone (TDA) have been prepared and their effect on growth in vivo of tumorigenic but not metastatic cell strain (LY-R) of mouse lymphoma L5178Y has been investigated. Polyamine derivatives of TDA
F B Daniel et al.
Drug and chemical toxicology, 16(4), 341-350 (1993-01-01)
1,3-Dichloropropanone (1,3-DCP) has been identified as a by-product of the chlorination of water and thus a potential contaminant in drinking water. Since little was known of its oral toxicity, subchronic exposure studies were conducted with male and female Sprague-Dawley rats

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