CAS
50528-53-5 Purity
96%
50528-53-5 Purity
96%
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2-Chloro-5-(trifluoromethyl)phenyl isocyanate
CAS
50528-86-4
Catalog Number
ACM50528864
Category
Other Products
Molecular Weight
221.56
Molecular Formula
C8H3ClF3NO
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- Product Description
- Case Study
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- Synthetic Use
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Specification
Synonyms
374865_ALDRICH, STK502578, ZINC02384709, ALBB-003058, CID2733263, 1-chloro-2-isocyanato-4-(trifluoromethyl)benzene, 2-Chloro-5-(trifluoromethyl)phenyl isocyanate, 50528-86-4
IUPAC Name
1-chloro-2-isocyanato-4-(trifluoromethyl)benzene
Canonical SMILES
C1=CC(=C(C=C1C(F)(F)F)N=C=O)Cl
InChI Key
WEPYOPYMWSHRIW-UHFFFAOYSA-N
Boiling Point
63-64ºC5 mm Hg(lit.)
Flash Point
198 °F
Density
1.48
Appearance
colorless to light yellow liquid
Exact Mass
220.98600
Hazard Statements
Xn,Xi,C
H-Bond Acceptor
5
H-Bond Donor
0
Packing Group
III
Safety Description
S23-S26-S45
WGK Germany
3
Downstream Synthesis Route 1
- 50528-86-4
- 95-76-1
- 584-81-6
Reference: [1]Patent: US2745874,1954,
Downstream Synthesis Route 2
- 50528-86-4
- 50903-32-7
- 28396-13-6
Reference: [1]Patent: DE2004302,1970,
Downstream Synthesis Route 3
- 50528-86-4
- 13683-89-1
- 23122-52-3
Reference: [1]Patent: FR1531794,1968,
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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