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线性分子式:
ClC6H4NCO
化学文摘社编号:
分子量:
153.57
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
203-176-9
Beilstein/REAXYS Number:
386235
MDL number:
Assay:
98%
Form:
solid
InChI
1S/C7H4ClNO/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChI key
ADAKRBAJFHTIEW-UHFFFAOYSA-N
SMILES string
Clc1ccc(cc1)N=C=O
assay
98%
form
solid
refractive index
n20/D 1.5618 (lit.)
bp
203-204 °C (lit.)
mp
26-29 °C (lit.)
density
1.2 g/mL at 25 °C (lit.)
functional group
chloro, isocyanate
storage temp.
2-8°C
Quality Level
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Application
4-Chlorophenyl isocyanate was used in the preparation of isothiocyanates.
signalword
Danger
Hazard Classifications
Acute Tox. 2 Inhalation - Acute Tox. 3 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Eye Dam. 1 - Resp. Sens. 1 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
wgk
WGK 3
flash_point_f
194.0 °F - closed cup
flash_point_c
90 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
A Convenient synthesis of isothiocyanates from primary nitroalkanes.
Synthetic Communications, 24(8), 1101-1105 (1994)
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