Home Sulfos 1-tert-Butyl-1h-pyrazole-4-sulfonyl chloride

1-tert-Butyl-1h-pyrazole-4-sulfonyl chloride

CAS No.:
1156603-97-2
Catalog Number:
AG00HD1F
Molecular Formula:
C7H11ClN2O2S
Molecular Weight:
222.6924
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Product Description
Catalog Number:
AG00HD1F
Chemical Name:
1-tert-Butyl-1h-pyrazole-4-sulfonyl chloride
CAS Number:
1156603-97-2
Molecular Formula:
C7H11ClN2O2S
Molecular Weight:
222.6924
MDL Number:
MFCD12192703
IUPAC Name:
1-tert-butylpyrazole-4-sulfonyl chloride
InChI:
InChI=1S/C7H11ClN2O2S/c1-7(2,3)10-5-6(4-9-10)13(8,11)12/h4-5H,1-3H3
InChI Key:
IPROHKMRBNXXDG-UHFFFAOYSA-N
SMILES:
CC(n1ncc(c1)S(=O)(=O)Cl)(C)C
Properties
Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.023g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.687g/mol
Monoisotopic Mass:
222.023g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties