产品名称
1,3-二氯丙酮, ≥95%
InChI key
SUNMBRGCANLOEG-UHFFFAOYSA-N
InChI
1S/C3H4Cl2O/c4-1-3(6)2-5/h1-2H2
SMILES string
ClCC(=O)CCl
vapor density
4.38 (vs air)
vapor pressure
<0.1 mmHg ( 20 °C)
assay
≥95%
form
solid
bp
173 °C (lit.)
mp
39-41 °C (lit.)
solubility
alcohol: very soluble
diethyl ether: very soluble
water: soluble
density
1.383 g/mL at 25 °C (lit.)
functional group
chloro
ketone
storage temp.
2-8°C
Quality Level
Application
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。
General description
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。
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。
signalword
Danger
Hazard Classifications
Acute Tox. 1 Inhalation - Acute Tox. 2 Dermal - Acute Tox. 2 Oral - Muta. 2 - Skin Corr. 1B
存储类别
6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
法规信息
危险化学品
此项目有
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)
Exploring the Use of Helicogenic Amino Acids for Optimising Single Chain Relaxin-3 Peptide Agonists.
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
1, 3-Dichloroacetone
Vittorio and Pace
Synlett, 2010, 2825-2826 (2010)
1, 3-Dichloroacetone: A Robust Reagent for Preparing Bicyclic Peptides
Qingqing L et al.
ACS Omega, 5, 1840-1850 (2020)
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
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