Home Sulfos 3-tert-butyl-1-methyl-1H-pyrazole-4-sulfonyl chloride

3-tert-butyl-1-methyl-1H-pyrazole-4-sulfonyl chloride

CAS No.:
1497169-40-0
Catalog Number:
AG01B3A0
Molecular Formula:
C8H13ClN2O2S
Molecular Weight:
236.7190
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Product Description
Catalog Number:
AG01B3A0
Chemical Name:
3-tert-butyl-1-methyl-1H-pyrazole-4-sulfonyl chloride
CAS Number:
1497169-40-0
Molecular Formula:
C8H13ClN2O2S
Molecular Weight:
236.7190
MDL Number:
MFCD21666993
IUPAC Name:
3-tert-butyl-1-methylpyrazole-4-sulfonyl chloride
InChI:
InChI=1S/C8H13ClN2O2S/c1-8(2,3)7-6(14(9,12)13)5-11(4)10-7/h5H,1-4H3
InChI Key:
ZRAZJRKZYZHTML-UHFFFAOYSA-N
SMILES:
Cn1nc(c(c1)S(=O)(=O)Cl)C(C)(C)C
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.039g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.714g/mol
Monoisotopic Mass:
236.039g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties