Home Sulfos 1-cyclobutyl-1H-pyrazole-4-sulfonyl chloride

1-cyclobutyl-1H-pyrazole-4-sulfonyl chloride

CAS No.:
1544955-53-4
Catalog Number:
AG01BKET
Molecular Formula:
C7H9ClN2O2S
Molecular Weight:
220.6766
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Product Description
Catalog Number:
AG01BKET
Chemical Name:
1-cyclobutyl-1H-pyrazole-4-sulfonyl chloride
CAS Number:
1544955-53-4
Molecular Formula:
C7H9ClN2O2S
Molecular Weight:
220.6766
MDL Number:
MFCD22548965
IUPAC Name:
1-cyclobutylpyrazole-4-sulfonyl chloride
InChI:
InChI=1S/C7H9ClN2O2S/c8-13(11,12)7-4-9-10(5-7)6-2-1-3-6/h4-6H,1-3H2
InChI Key:
MLDUUKSSKFCFRB-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1cnn(c1)C1CCC1
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.007g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.671g/mol
Monoisotopic Mass:
220.007g/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