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About This Item
Linear Formula:
ClCH2CH2NCO
CAS Number:
Molecular Weight:
105.52
Beilstein:
1071429
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Quality Level
Assay
97%
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
SMILES string
ClCCN=C=O
InChI
1S/C3H4ClNO/c4-1-2-5-3-6/h1-2H2
InChI key
BCMYXYHEMGPZJN-UHFFFAOYSA-N
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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
Signal Word
Danger
Hazard Statements
Precautionary Statements
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
Storage Class Code
3 - Flammable liquids
WGK
WGK 3
Flash Point(F)
132.8 °F - closed cup
Flash Point(C)
56 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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