41368
对-甲基苯磺酰异氰酸酯
derivatization grade (HPLC), LiChropur™, ≥98.0% (GC)
别名:
4-甲苯磺酰异氰酸酯
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关于此项目
线性分子式:
CH3C6H4SO2NCO
化学文摘社编号:
分子量:
197.21
UNSPSC Code:
41116105
NACRES:
NA.22
PubChem Substance ID:
EC Number:
223-810-8
Beilstein/REAXYS Number:
391287
MDL number:
Assay:
≥98.0% (GC)
Form:
liquid
grade
derivatization grade (HPLC)
Quality Level
vapor pressure
1 mmHg ( 100 °C)
assay
≥98.0% (GC)
form
liquid
quality
LiChropur™
technique(s)
HPLC: suitable
refractive index
n20/D 1.533-1.537, n20/D 1.534 (lit.)
bp
144 °C/10 mmHg (lit.), 275-278 °C (lit.)
density
1.291 g/mL at 25 °C (lit.)
SMILES string
Cc1ccc(cc1)S(=O)(=O)N=C=O
InChI
1S/C8H7NO3S/c1-7-2-4-8(5-3-7)13(11,12)9-6-10/h2-5H,1H3
InChI key
VLJQDHDVZJXNQL-UHFFFAOYSA-N
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General description
p-Toluenesulfonyl isocyanate, a sulfonyl isocyanate derivative, is a highly reactive compound that finds application as a water scavenger. It is used as a component of polyurethane coatings, sealants, adhesives and as an intermediate of several industrially important chemicals.
Application
p-Toluenesulfonyl isocyanate may be used as a derivatization reagent for the analyses of diethylene glycol and propylene glycol in pharmaceutical products, stereoisomers of 3-hydroxyl-7-methyl-norethynodrel in biological samples, and pyrrolizidine alkaloids in herbal tea formulations by high performance liquid chromatography (HPLC) based techniques.
Legal Information
LiChropur is a trademark of Merck KGaA, Darmstadt, Germany
signalword
Danger
hcodes
Hazard Classifications
Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
10 - Combustible liquids
wgk
WGK 1
flash_point_f
294.8 °F - closed cup
flash_point_c
146 °C - closed cup
K Parimala et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 81(1), 711-723 (2011-07-29)
The Fourier transform infrared (FTIR) and FT Raman spectra of p-toluenesulfonyl isocyanate (p-tosyl isocyanate) have been measured. The molecular geometry, vibrational frequencies, infrared intensities, Raman activities and atomic charges have been calculated by using ab initio HF and density functional
Inga Mädge et al.
Food chemistry, 187, 491-498 (2015-05-16)
A general contamination of tea with pyrrolizidine alkaloids (PA) has just become known. Here, we report the application and modification of a new HPLC-ESI-MS/MS sum parameter method to quantitate PA content of herbal teas intended for infants, pregnant and lactating
Ming Zuo et al.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences, 814(2), 331-337 (2005-01-11)
In this paper, p-toluenesulfonyl isocyanate has been reported as a novel derivatization reagent with strong nuclephilic reactivity for the hydroxyl compounds. The derivatization for the two pharmacologically active 3-hydroxyl metabolites, 3alpha-hydroxyl-7-methyl-norethynodrel and 3beta-hydroxyl-7-methyl-norethynodrel by p-toluenesulfonyl isocyanate can be accomplished in
Tao Zhou et al.
Journal of separation science, 30(16), 2620-2627 (2007-09-21)
A simple and reliable HPLC method was developed for the simultaneous quantitative analysis of diethylene glycol (DEG) and propylene glycol (PG) in pharmaceutical products by precolumn derivatization. The derivatization reagent p-toluenesulfonyl isocyanate (TSIC, 10 microL, 20% in ACN v/v) was
全球贸易项目编号
| 货号 | GTIN |
|---|---|
| 41368-10X1ML | 04061838195845 |
| 41368-1ML | 04061838202932 |
| 41368-10ML | 04061838195838 |
| 41368-1ML-KC | 04061838002624 |
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