1005627-55-3,MFCD04968671
Catalog No.:AA008S94

1005627-55-3 | 1-Ethyl-3-methyl-1h-pyrazole-4-sulfonyl chloride

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$123.00   $86.00
- +
5g
95%
in stock  
$489.00   $343.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA008S94
Chemical Name:
1-Ethyl-3-methyl-1h-pyrazole-4-sulfonyl chloride
CAS Number:
1005627-55-3
Molecular Formula:
C6H9ClN2O2S
Molecular Weight:
208.6659
MDL Number:
MFCD04968671
SMILES:
CCN1C=C(C(=N1)C)S(=O)(=O)Cl
Properties
Computed Properties
 
Complexity:
249  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1  

Downstream Synthesis Route

[1]CurrentPatentAssignee:CORTEVAINC-WO2010/129500,2010,A2Locationinpatent:Page/Pagecolumn60

[1]CurrentPatentAssignee:PHPHARMACOLTD-US2011/34433,2011,A1Locationinpatent:Page/Pagecolumn70

1005627-55-3   
(R)-tert-butyl(2-(acetamidomethyl)-3,4-dihydro-2H-benzob1,4oxazin-6-yl)carbamate 
 
(S)-tert-butyl(2-(acetamidomethyl)-4-((1-ethyl-3-methyl-1H-pyrazol-4-yl)sulfonyl)-3,4-dihydro-2H-benzob1,4oxazin-6-yl)carbamate 

[1]CurrentPatentAssignee:MERCK&COINC-WO2015/95788,2015,A1Locationinpatent:Paragraph0248

1005627-55-3    1353184-54-9   
2-{4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)sulfonylpiperazin-1-yl}-8-nitro-6-(trifluoromethyl)-4H-1,3-benzothiazin-4-one 

[1]Piton,Jérémie;Vocat,Anthony;Lupien,Andréanne;Foo,CarolineS.;Riabov,Olga;Makarov,Vadim;Cole,StewartT.[AntimicrobialAgentsandChemotherapy,2018,vol.62,#10]

Literature
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SDS
Tags:1005627-55-3 Molecular Formula|1005627-55-3 MDL|1005627-55-3 SMILES|1005627-55-3 1-Ethyl-3-methyl-1h-pyrazole-4-sulfonyl chloride
Catalog No.: AA008S94
1005627-55-3,MFCD04968671
1005627-55-3 | 1-Ethyl-3-methyl-1h-pyrazole-4-sulfonyl chloride
Pack Size: 1g
Purity: 95%
in stock
$123.00 $86.00
Pack Size: 5g
Purity: 95%
in stock
$489.00 $343.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA008S94
Chemical Name: 1-Ethyl-3-methyl-1h-pyrazole-4-sulfonyl chloride
CAS Number: 1005627-55-3
Molecular Formula: C6H9ClN2O2S
Molecular Weight: 208.6659
MDL Number: MFCD04968671
SMILES: CCN1C=C(C(=N1)C)S(=O)(=O)Cl
Properties
Complexity: 249  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1  
Downstream Synthesis Route
1005627-55-3    904491-26-5 

[1]CurrentPatentAssignee:CORTEVAINC-WO2010/129500,2010,A2Locationinpatent:Page/Pagecolumn60

1005627-55-3    1161921-55-6    1164203-03-5 

[1]CurrentPatentAssignee:PHPHARMACOLTD-US2011/34433,2011,A1Locationinpatent:Page/Pagecolumn70

1005627-55-3   
(R)-tert-butyl(2-(acetamidomethyl)-3,4-dihydro-2H-benzob1,4oxazin-6-yl)carbamate 
 
(S)-tert-butyl(2-(acetamidomethyl)-4-((1-ethyl-3-methyl-1H-pyrazol-4-yl)sulfonyl)-3,4-dihydro-2H-benzob1,4oxazin-6-yl)carbamate 

[1]CurrentPatentAssignee:MERCK&COINC-WO2015/95788,2015,A1Locationinpatent:Paragraph0248

1005627-55-3    1353184-54-9   
2-{4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)sulfonylpiperazin-1-yl}-8-nitro-6-(trifluoromethyl)-4H-1,3-benzothiazin-4-one 

[1]Piton,Jérémie;Vocat,Anthony;Lupien,Andréanne;Foo,CarolineS.;Riabov,Olga;Makarov,Vadim;Cole,StewartT.[AntimicrobialAgentsandChemotherapy,2018,vol.62,#10]

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