472190
2-氟-5-(三氟甲基)苯基异氰酸酯
97%
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关于此项目
线性分子式:
FC6H3(CF3)NCO
化学文摘社编号:
分子量:
205.11
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
产品名称
2-氟-5-(三氟甲基)苯基异氰酸酯, 97%
InChI
1S/C8H3F4NO/c9-6-2-1-5(8(10,11)12)3-7(6)13-4-14/h1-3H
SMILES string
Fc1ccc(cc1N=C=O)C(F)(F)F
InChI key
NAIKHCBDZGSGHH-UHFFFAOYSA-N
assay
97%
refractive index
n20/D 1.455 (lit.)
bp
53 °C/2.5 mmHg (lit.)
density
1.418 g/mL at 25 °C (lit.)
functional group
fluoro
isocyanate
Quality Level
Application
由胺制备尿素的有效制药结构单元。
General description
2-Fluoro-5-(trifluoromethyl)phenyl isocyanate is a fluorinated building block.
signalword
Danger
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
存储类别
10 - Combustible liquids
wgk
WGK 3
flash_point_f
159.8 °F - closed cup
flash_point_c
71 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Zhiqin Ji et al.
Bioorganic & medicinal chemistry letters, 16(16), 4326-4330 (2006-06-01)
A series of isothiazolopyrimidines and isoxazolopyrimidines were synthesized and identified as potent KDR inhibitors. SAR studies led to isothiazolopyrimidine urea analogs that potently inhibit VEGFR tyrosine kinases (KDR enzymatic and cellular IC(50) values below 10 nM) as well as cKIT
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