Home Sulfos 4-formyl-1-methyl-1H-pyrazole-5-sulfonyl chloride

4-formyl-1-methyl-1H-pyrazole-5-sulfonyl chloride

CAS No.:
2138573-84-7
Catalog Number:
AG01EIWQ
Molecular Formula:
C5H5ClN2O3S
Molecular Weight:
208.6228
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Product Description
Catalog Number:
AG01EIWQ
Chemical Name:
4-formyl-1-methyl-1H-pyrazole-5-sulfonyl chloride
CAS Number:
2138573-84-7
Molecular Formula:
C5H5ClN2O3S
Molecular Weight:
208.6228
MDL Number:
MFCD31559314
IUPAC Name:
4-formyl-2-methylpyrazole-3-sulfonyl chloride
InChI:
InChI=1S/C5H5ClN2O3S/c1-8-5(12(6,10)11)4(3-9)2-7-8/h2-3H,1H3
InChI Key:
DXNRFSKKWVFYPL-UHFFFAOYSA-N
SMILES:
O=Cc1cnn(c1S(=O)(=O)Cl)C
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.971g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.616g/mol
Monoisotopic Mass:
207.971g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties