2-Phenoxyphenylisocyanate
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2-Phenoxyphenylisocyanate
structure -
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CAS No:
59377-20-7
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Formula:
C13H9NO2
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Chemical Name:
2-Phenoxyphenylisocyanate
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Synonyms:
Benzene,1-isocyanato-2-phenoxy-;Isocyanic acid,o-phenoxyphenyl ester;1-Isocyanato-2-phenoxybenzene;2-Phenoxyphenylisocyanate;o-Phenoxyphenyl isocyanate
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CAS No:
Characteristics
38.66000
3.44620
1.168 g/mL at 25 °C(lit.)
162-164 °C @ Press: 14 Torr
>230 °F
n20/D 1.588(lit.)
Safety Information
UN 2206 6.1/PG 3
3
20/21/22-36/37/38
26-36-45-36/37/39-27
Xn
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 (100%): 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 194 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:211.22
XLogP3:4.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:211.063328530
Monoisotopic Mass:211.063328530
Topological Polar Surface Area:38.7
Heavy Atom Count:16
Complexity:255
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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