159352
2-Fluorophenyl isocyanate
97%
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About This Item
Linear Formula:
FC6H4NCO
CAS Number:
Molecular Weight:
137.11
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
240-804-0
MDL number:
Assay:
97%
Form:
liquid
Quality Level
assay
97%
form
liquid
refractive index
n20/D 1.5144 (lit.)
density
1.222 g/mL at 25 °C (lit.)
functional group
fluoro, isocyanate
storage temp.
2-8°C
SMILES string
Fc1ccccc1N=C=O
InChI
1S/C7H4FNO/c8-6-3-1-2-4-7(6)9-5-10/h1-4H
InChI key
VZNCSZQPNIEEMN-UHFFFAOYSA-N
General description
2-Fluorophenyl isocyanate is the main component of essential oil from Rhododendron thymifolium Maxim. Molecular geometry of 2-fluorophenyl isocyanate has been investigated by microwave spectroscopy and nuclear magnetic resonance spectroscopy.
signalword
Danger
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 3 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
123.8 °F - closed cup
flash_point_c
51 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
危险化学品
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Studies on the Essential Constituent of Rhododendron thymifolium Maxim.
Ji Z, et al.
Acta Horticulturae Sinica, 29(4), 386-388 (2002)
Microwave spectroscopy and nuclear magnetic resonance study of the molecular geometry of 2-fluorophenylisocyanate.
Masson MA, et al.
Journal of Molecular Structure, 68, 307-314 (1980)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 159352-25G | 04061836825430 |
| 159352-5G | 04061838744500 |