Home Sulfos 4-ethynyl-1-(methylsulfonyl)piperidine

4-ethynyl-1-(methylsulfonyl)piperidine

CAS No.:
959918-30-0
Catalog Number:
AG01BKDN
Molecular Formula:
C8H13NO2S
Molecular Weight:
187.2593
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Product Description
Catalog Number:
AG01BKDN
Chemical Name:
4-ethynyl-1-(methylsulfonyl)piperidine
CAS Number:
959918-30-0
Molecular Formula:
C8H13NO2S
Molecular Weight:
187.2593
MDL Number:
MFCD26399772
IUPAC Name:
4-ethynyl-1-methylsulfonylpiperidine
InChI:
InChI=1S/C8H13NO2S/c1-3-8-4-6-9(7-5-8)12(2,10)11/h1,8H,4-7H2,2H3
InChI Key:
LBMKSUJQMGXWEJ-UHFFFAOYSA-N
SMILES:
C#CC1CCN(CC1)S(=O)(=O)C
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.067g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.257g/mol
Monoisotopic Mass:
187.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties