3-CHLORO-4-FLUOROPHENYL ISOCYANATE
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3-CHLORO-4-FLUOROPHENYL ISOCYANATE
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CAS No:
50529-33-4
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Formula:
C7H3ClFNO
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Chemical Name:
3-CHLORO-4-FLUOROPHENYL ISOCYANATE
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Synonyms:
3-CHLORO-4-FLUOROPHENYL ISOCYANATE;3-Chloro-4-fluorophenyl isocyanate 97%;3-Chloro-4-fluorophenylisocyanate97%;3-Chloro-4-fluorophenyl isocyanate,98%;2-chloro-1-fluoro-4-isocyanatobenzene(SALTDATA: FREE)
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CAS No:
3-CHLORO-4-FLUOROPHENYL ISOCYANATE Basic Attributes
171.56
170.98900
973324
DTXSID10370408
2929109000
Characteristics
29.4
2.44640
Clear colorless to slightly yellow Liquid
1.377 g/mL at 25 °C(lit.)
44 °C17 mm Hg(lit.)
190 °F
n20/D 1.541(lit.)
Refrigerator (+4°C)
Safety Information
III
6.1
UN 2206 6.1/PG 2
3
20/21/22-36/37/38-42-25-23
26-36/37/39-45-23
Xn,T,Xi
Toxic
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501
H302
|Warning|H302 (90.48%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:171.55
XLogP3:3.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:170.9887196
Monoisotopic Mass:170.9887196
Topological Polar Surface Area:29.4
Heavy Atom Count:11
Complexity:181
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-CHLORO-4-FLUOROPHENYL ISOCYANATE
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