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[ CAS No. 1193-02-8 ] {[proInfo.proName]}

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Chemical Structure| 1193-02-8
Chemical Structure| 1193-02-8
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Product Details of [ 1193-02-8 ]

CAS No. :1193-02-8 MDL No. :MFCD00007880
Formula : C6H7NS Boiling Point : -
Linear Structure Formula :- InChI Key :WCDSVWRUXWCYFN-UHFFFAOYSA-N
M.W : 125.19 Pubchem ID :14510
Synonyms :

Safety of [ 1193-02-8 ]

Signal Word:Danger Class:8
Precautionary Statements:P501-P260-P270-P264-P280-P303+P361+P353-P301+P330+P331-P363-P301+P312+P330-P304+P340+P310-P305+P351+P338+P310-P405 UN#:3263
Hazard Statements:H302-H314 Packing Group:Ⅱ
GHS Pictogram:

Application In Synthesis of [ 1193-02-8 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 1193-02-8 ]

[ 1193-02-8 ] Synthesis Path-Downstream   1~9

  • 1
  • [ 57616-74-7 ]
  • [ 108-24-7 ]
  • [ 1193-02-8 ]
  • acetic acid-[4-(3-morpholino-propylmercapto)-anilide] [ No CAS ]
  • 2
  • [ 3034-48-8 ]
  • [ 1193-02-8 ]
  • [ 53469-34-4 ]
  • 3
  • [ 53595-65-6 ]
  • [ 1193-02-8 ]
  • [ 63031-88-9 ]
  • 4
  • [ 3883-39-4 ]
  • [ 1193-02-8 ]
  • [ 136401-90-6 ]
  • 5
  • [ 34107-46-5 ]
  • [ 1193-02-8 ]
  • 4-[[(6-methyl-3-pyridinyl)methyl]sulfanyl]aniline [ No CAS ]
YieldReaction ConditionsOperation in experiment
(6-methyl-3-pyridinyl)methanol (3.0 g) was dissolved in methylene chloride (30 ml), and to this solution was added DMF (3 droplets) and then, thionyl chloride (3.56 ml) at 0C, and the mixture was stirred for 2 hours at room temperature. The solvent was removed under reduced pressure, and a solution of the obtained residue in methanol (20 ml) was added dropwise to a solution (41.2 ml) of 4-aminothiophenol (2.74 g) and 3N sodium hydroxide (24.4 ml) in methanol at 0C. The mixture was stirred for 30 minutes at room temperature, the solvent was removed under reduced pressure, and the obtained residue was added to water and extracted with ethyl acetate. The organic layer was washed with saturated brine, and dried over magnesium sulfate. The solvent was removed under reduced pressure and the obtained residue was washed with hexane/ethyl acetate, to give 4-[[(6-methyl-3-pyridinyl)methyl]sulfanyl]aniline (4.2 g). 1H-NMR (200 MHz, CDCl3) delta 2.51 (3H, s), 2.73 (2H, br), 3.86 (2H, s), 6.53 to 6.58 (2H, m), 7.01 to 7.08 (3H, m), 7.34 to 7.40 (1H, m), 8.18 (1H, d, J = 2.2 Hz)
  • 6
  • [ 35144-22-0 ]
  • [ 1193-02-8 ]
  • [ 102243-12-9 ]
YieldReaction ConditionsOperation in experiment
75% With potassium carbonate; In N,N-dimethyl-formamide; at 100℃; for 2h; General procerure: A solution of <strong>[35144-22-0]4,6-dimethyl-2-(methylsulfonyl)pyrimidine</strong> (18 mmol), 4-aminophenol or 4-aminobenzenethiol (18 mmol) and K2CO3 (36 mmol) in DMF (50 mL) was stirred at 100 C for 2 h. The reaction mixture was poured into water and extracted with EtOAc. The organic layer was washed with water and saturated brine, dried over Na2SO4 and evaporated. The residue was purified by column chromatography on silica gel (PE:EA = 2:1) to give the compound 3a,3b.
  • 7
  • [ 207399-07-3 ]
  • [ 1193-02-8 ]
  • C42H50N3S(1+)*I(1-) [ No CAS ]
YieldReaction ConditionsOperation in experiment
79.4% In N,N-dimethyl-formamide; at 20℃; The main process for chemical synthesis in thisexample was shown in FIG. 2. The synthesis steps were asfollows. IR780 iodide (2-[2-[2-Chloro-3-(1,3-dihydro-3,3-dimethyl-1-propyl-2H -indol-2-ylidene) ethylidene ]-1-cyclohexen-1-yl]etheny 1]-3,3 -dimethy 1-1-propy lindoliumiodide) (120 mg, 143.2 flillOl) and 4-aminothiophenol (300mg, 958 flillOl) were dissolved in anhydrous DMF (5 ml),and reacted overnight at room temperature. The obtainedcrude product was purified by preparative HPLC coupledwith a C-18 colunm, to obtain a pure target product IR780-NH2. A green solid (120 mg, 79.4%) was obtained afterdrying, which was then analyzed by HPLC, and identified bynuclear magnetic resonance spectrometry and mass spectrometry.IR780-NH2 (75.5 mg, 100 f.tmol) was dissolved inanhydrous DMF (5 ml), and triethyl amine (20 mg, 200f.tmol) was added. Then, a solution ofDOTA-NHS (153 mg,200 flillOl) dissolved in DMF (1 ml) was added to thereaction mixture, and stirred for 3 days at room temperature.The obtained crude product was purified by preparativeHPLC coupled with a C-18 colunm using, as a mobile phase,60% CAN and 40% H20 containing 0.1% TFA which wasgradient to 100% ACN in 15 min, to obtain a pure targetproduct. A green solid (21 mg, 17.2%) was obtained afterdrying, and the structure of the multi-functional probe of thepresent invention was determined after analysis by HPLCand identification by nuclear magnetic resonance spectrometryand mass spectrometry.
75% In N,N-dimethyl-formamide; at 25℃; for 10h;Inert atmosphere; Schlenk technique; A mixture of compounds <strong>[207399-07-3]IR-780</strong> (333.65mg, 0.5mmol) and 4-amino thiophenol (69mg, 0.55mmol) were stirred in DMF (5mL) for 10h under an argon atmosphere at 25C. After completion of present reaction, the solvent was removed under reduced pressure. The crude mixture was purified by flash chromatography on silica gel using dichloromethane/methanol (60: 1) to give 2 (278mg, 75%).1H NMR (400MHz, CDCl3): δ ppm=1.06 (t, J=16Hz, 6H, CH3), 1.56 (s, 12H, CH3), 1.89 (q, 4H, CH2), 2.00 (t, J=12Hz, 2H, CH2), 2.71 (t, J=12Hz, 4H, CH2), 4.08 (t, J=16Hz, 4H, CH2), 6.14 (d, J=16Hz, 2H, CH2=CH-H), 6.64 (d, J=8Hz, 2H, Ar-H), 7.00 (d, J=12Hz, 2H, Ar-H), 7.11 (d, J=8Hz, 2H, Ar-H), 7.21 (t, J=12Hz, 3H, Ar-H). 7.31 (d, 1H, Ar-H). 7.33 (d, J=4Hz, 2H, Ar-H). 7.36 (d, J=8Hz, 2H, Ar-H). 8.74 (d, J=16Hz, 2H, CH2=CH-H).
  • 8
  • [ 1897-41-2 ]
  • [ 1193-02-8 ]
  • 2,3,5,6-tetrakis((4-aminophenyl)thio)terephthalonitrile [ No CAS ]
  • 9
  • [ 1753-75-9 ]
  • [ 1193-02-8 ]
  • C12H9N3S2 [ No CAS ]
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