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[ CAS No. 7709-13-9 ]

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2D
Chemical Structure| 7709-13-9
Chemical Structure| 7709-13-9
Structure of 7709-13-9 *Storage: {[proInfo.prStorage]}

Quality Control of [ 7709-13-9 ]

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Product Details of [ 7709-13-9 ]

CAS No. :7709-13-9MDL No. :MFCD19203794
Formula :C3H3ClN4Boiling Point :383.3°C at 760 mmHg
Linear Structure Formula :-InChI Key :N/A
M.W :130.54Pubchem ID :24381
Synonyms :

Computed Properties of [ 7709-13-9 ]

TPSA : 64.7 H-Bond Acceptor Count : 4
XLogP3 : 0.6 H-Bond Donor Count : 1
SP3 : 0.00 Rotatable Bond Count : 0

Safety of [ 7709-13-9 ]

Signal Word:WarningClassN/A
Precautionary Statements:P280-P305+P351+P338UN#:N/A
Hazard Statements:H302Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 7709-13-9 ]

  • Upstream synthesis route of [ 7709-13-9 ]
  • Downstream synthetic route of [ 7709-13-9 ]

[ 7709-13-9 ] Synthesis Path-Upstream   1~4

  • 1
  • [ 2831-66-5 ]
  • [ 7709-13-9 ]
YieldReaction ConditionsOperation in experiment
46% at -20℃; for 0.17 h; 2,4-dichloro-l,3,5-triazine(45 mg, 0.3 mmol) was added to 2 mL of ΝΗ4OH aq., the reaction was stirred at -20 °C for 10 min, then filtered, washed with water and dried to give 4-chloro- l,3,5-triazin-2-amine (18 mg, yield: 46percent) as a yellow solid which was used in the next step without further purification. MS (m/z): 131.0 (M+H)+.
46% at -20℃; for 0.17 h; 2,4-dichloro-1,3,5-triazine(45 mg, 0.3 mmol) was added to 2 mL of ΝΗ4OH aq., the reaction was stirred at -20 °C for 10 min, then filtered, washed with water and dried to give 4-chloro- l,3,5-triazin-2-amine (18 mg, yield: 46percent) as a yellow solid which was used in the next step without further purification. MS (m/z): 131.0 (M+H)+.
Reference: [1] Patent: WO2014/15523, 2014, A1. Location in patent: Page/Page column 126; 127
[2] Patent: WO2014/15830, 2014, A1. Location in patent: Page/Page column 151
[3] Agricultural and Biological Chemistry, 1982, vol. 46, # 6, p. 1439 - 1445
[4] Patent: WO2011/146882, 2011, A1. Location in patent: Page/Page column 108
[5] Patent: WO2014/15675, 2014, A1. Location in patent: Page/Page column 151; 152
[6] Patent: WO2018/39972, 2018, A1. Location in patent: Page/Page column 180
  • 2
  • [ 1912-24-9 ]
  • [ 7709-13-9 ]
Reference: [1] Agricultural and Biological Chemistry, 1980, vol. 44, # 9, p. 2067 - 2072
  • 3
  • [ 2831-66-5 ]
  • [ 7709-13-9 ]
YieldReaction ConditionsOperation in experiment
46% at -20℃; for 0.17 h; 2,4-dichloro-l,3,5-triazine(45 mg, 0.3 mmol) was added to 2 mL of ΝΗ4OH aq., the reaction was stirred at -20 °C for 10 min, then filtered, washed with water and dried to give 4-chloro- l,3,5-triazin-2-amine (18 mg, yield: 46percent) as a yellow solid which was used in the next step without further purification. MS (m/z): 131.0 (M+H)+.
46% at -20℃; for 0.17 h; 2,4-dichloro-1,3,5-triazine(45 mg, 0.3 mmol) was added to 2 mL of ΝΗ4OH aq., the reaction was stirred at -20 °C for 10 min, then filtered, washed with water and dried to give 4-chloro- l,3,5-triazin-2-amine (18 mg, yield: 46percent) as a yellow solid which was used in the next step without further purification. MS (m/z): 131.0 (M+H)+.
Reference: [1] Patent: WO2014/15523, 2014, A1. Location in patent: Page/Page column 126; 127
[2] Patent: WO2014/15830, 2014, A1. Location in patent: Page/Page column 151
[3] Agricultural and Biological Chemistry, 1982, vol. 46, # 6, p. 1439 - 1445
[4] Patent: WO2011/146882, 2011, A1. Location in patent: Page/Page column 108
[5] Patent: WO2014/15675, 2014, A1. Location in patent: Page/Page column 151; 152
[6] Patent: WO2018/39972, 2018, A1. Location in patent: Page/Page column 180
  • 4
  • [ 1912-24-9 ]
  • [ 7709-13-9 ]
Reference: [1] Agricultural and Biological Chemistry, 1980, vol. 44, # 9, p. 2067 - 2072
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