Home Sulfos 1-(cyclobutylmethyl)-1H-pyrazole-5-sulfonyl chloride

1-(cyclobutylmethyl)-1H-pyrazole-5-sulfonyl chloride

CAS No.:
1785243-74-4
Catalog Number:
AG01BT6Q
Molecular Formula:
C8H11ClN2O2S
Molecular Weight:
234.7031
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Product Description
Catalog Number:
AG01BT6Q
Chemical Name:
1-(cyclobutylmethyl)-1H-pyrazole-5-sulfonyl chloride
CAS Number:
1785243-74-4
Molecular Formula:
C8H11ClN2O2S
Molecular Weight:
234.7031
MDL Number:
MFCD28614227
IUPAC Name:
2-(cyclobutylmethyl)pyrazole-3-sulfonyl chloride
InChI:
InChI=1S/C8H11ClN2O2S/c9-14(12,13)8-4-5-10-11(8)6-7-2-1-3-7/h4-5,7H,1-3,6H2
InChI Key:
WFHAVZXYXJBGDX-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1ccnn1CC1CCC1
Properties
Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.023g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.698g/mol
Monoisotopic Mass:
234.023g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties