p-Toluenesulfonyl isocyanate
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p-Toluenesulfonyl isocyanate
structure -
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CAS No:
4083-64-1
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Formula:
C8H7NO3S
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Chemical Name:
p-Toluenesulfonyl isocyanate
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Synonyms:
Benzenesulfonyl isocyanate,4-methyl-;p-Toluenesulfonic acid,anhydride with isocyanic acid;Isocyanic acid,anhydride with p-toluenesulfonic acid;4-Methylbenzenesulfonyl isocyanate;p-Toluenesulfonyl isocyanate;4-Toluenesulfonyl isocyanate;p-Tosyl isocyanate;p-Methylphenylsulfonyl isocyanate;4-Methylphenylsulfonyl isocyanate;Tosyl isocyanate;p-Methylbenzenesulfonyl isocyanate;Additive TI;PTSI;Toluenesulfonyl isocyanate;4-Toluolsulfonyl isocyanate;HK-additive TI;TI;102086-99-7
- Categories:
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CAS No:
p-Toluenesulfonyl isocyanate Basic Attributes
197.21
197.21
391287
223-810-8
H9004FJX6V
DTXSID1027558
2929109000
Characteristics
72
2.44
Clear colorless to yellow Liquid
1.3±0.1 g/cm3
188-189 °C
114-116 °C @ Press: 0.3-0.5 Torr
>230 °F
1.566
Solubility in water: reaction
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep away from water.
1 mm Hg ( 100 °C)
Safety Information
III
6.1
UN 2206 6.1/PG 3
1
14-36/37/38-42
26-28-30-28A
DB9032000
Xn
Stable under normal temperatures and pressures. Combines vigorously or explosively with water.
P261-P284-P304 + P340 + P312-P305 + P351 + P338-P342 + P311-P403 + P233
H315-H319-H331-H334-H335
|Danger|H315: Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P285, P302+P352, P304+P340, P304+P341, P305+P351+P338, P312, P321, P332+P313, P337+P313, P342+P311, P362, P403+P233, P405, and P501|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|Aggregated GHS information provided by 627 companies from 20 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|P260, P261, P264, P270, P271, P272, P280, P284, P285, P302+P352, P304+P340, P304+P341, P305+P351+P338, P310, P312, P314, P320, P321, P332+P313, P333+P313, P337+P313, P342+P311, P362, P363, P403+P233, P405, and P501
p-Toluenesulfonyl isocyanate Use and Manufacturing
Reagent used to prepare acetylated syn-1,2-diols,1 oxazolidin-2-ones,2 2,3-diamino acids,3 and N-tosylcarbonamides.4
Adhesives and sealant chemicals
Automotive care products
Do It Yourself Consumer Automotive Application|Benzenesulfonyl isocyanate, 4-methyl-: ACTIVE
Computed Properties
Molecular Weight:197.21
XLogP3:2.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:197.01466426
Monoisotopic Mass:197.01466426
Topological Polar Surface Area:72
Heavy Atom Count:13
Complexity:303
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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