1-Isothiocyanato-4-phenoxybenzene
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1-Isothiocyanato-4-phenoxybenzene
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CAS No:
3529-87-1
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Formula:
C13H9NOS
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Chemical Name:
1-Isothiocyanato-4-phenoxybenzene
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Synonyms:
Benzene,1-isothiocyanato-4-phenoxy-;Isothiocyanic acid,p-phenoxyphenyl ester;1-Isothiocyanato-4-phenoxybenzene;4-Isothiocyanatodiphenyl ether;4-Phenoxyphenyl isothiocyanate
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CAS No:
Safety Information
UN 2811
20/21/22-36/37/38
26-36/37/39
T: Toxic;
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
Computed Properties
Molecular Weight:227.28
XLogP3:4.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:227.04048508
Monoisotopic Mass:227.04048508
Topological Polar Surface Area:53.7
Heavy Atom Count:16
Complexity:249
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-Isothiocyanato-4-phenoxybenzene
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