538337
异氰酸 2-氯乙酯
low HCl, 97%
别名:
β-Chloroethylisocyanate, 1-Chloro-2-isocyanatoethane
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关于此项目
线性分子式:
ClCH2CH2NCO
化学文摘社编号:
分子量:
105.52
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
217-734-4
Beilstein/REAXYS Number:
1071429
MDL number:
Assay:
97%
InChI
1S/C3H4ClNO/c4-1-2-5-3-6/h1-2H2
InChI key
BCMYXYHEMGPZJN-UHFFFAOYSA-N
SMILES string
ClCCN=C=O
assay
97%
Quality Level
refractive index
n20/D 1.447 (lit.)
bp
141-142 °C (lit.)
density
1.237 g/mL at 25 °C (lit.)
functional group
amine, chloro, isocyanate
storage temp.
2-8°C
Application
2-Chloroethyl isocyanate may be used in the synthesis of:
- 8-carbamoyl-3-(2-chloroethyl)imidazo[5,1-d]-l,2,3,5-tetrazin-4(3H)-one
- 1-(2-chloroethyl)-3-(2-hydroxyethyl) urea
- 3-substituted 1-(2-chloroethyl)-3-β-glycosylureas
- 1-(2-chloroethyl)-3-cyclohexyl-1-nitrosourea (CCNU)
- (2-chloroethyl)-4-acetoxybenzyl ester
signalword
Danger
Hazard Classifications
Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Eye Irrit. 2 - Flam. Liq. 3 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
存储类别
3 - Flammable liquids
wgk
WGK 3
flash_point_f
132.8 °F - closed cup
flash_point_c
56 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
新产品
此项目有
Synthesis and evaluation of several new (2-chloroethyl) nitrosocarbamates as potential anticancer agents
Reynolds RC, et al.
Journal of Medicinal Chemistry, 43.8, 1484-1488 (2000)
Antitumour imidazotetrazines. 1. Synthesis and chemistry of 8-carbamoyl-3-(2-chloroethyl) imidazo [5, 1-d]-1, 2, 3, 5-tetrazin-4 (3H)-one, a novel broad-spectrum antitumor agent
Stevens, Malcolm FG, et al.
Journal of Medicinal Chemistry, 27.2, 196-201 (1984)
Reactions of 1, 3-bis (2-chloroethyl)-1-nitrosourea and 1-(2-chloroethyl)-3-cyclohexyl-1-nitrosourea in aqueous solution
Weinkam RJ and Lin HS.
Journal of Medicinal Chemistry, 22.10, 1193-1198 (1979)
A new class of nitrosoureas. 4. Synthesis and antitumor activity of disaccharide derivatives of 3, 3-disubstituted 1-(2-chloroethyl)-1-nitrosoureas
Tsujihara, Kenji, et al.
Journal of Medicinal Chemistry, 25.4, 441-446 (1982)
M R Davis et al.
Chemical research in toxicology, 6(3), 376-383 (1993-05-01)
The antitumor agent N,N'-bis(2-chloroethyl)-N-nitrosourea (BCNU) is known to be unstable in aqueous solution, and to degrade spontaneously to reactive alkylating and carbamoylating intermediates. Whereas the alkylating component is believed to be responsible for the antitumor effects of this drug, it
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