Home Sulfos tert-Butyl 3-fluoro-4-((methylsulfonyloxy)methyl)piperidine-1-carboxylate

tert-Butyl 3-fluoro-4-((methylsulfonyloxy)methyl)piperidine-1-carboxylate

CAS No.:
1824168-69-5
Catalog Number:
AG01D8QP
Molecular Formula:
C12H22FNO5S
Molecular Weight:
311.3702
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Product Description
Catalog Number:
AG01D8QP
Chemical Name:
tert-Butyl 3-fluoro-4-((methylsulfonyloxy)methyl)piperidine-1-carboxylate
CAS Number:
1824168-69-5
Molecular Formula:
C12H22FNO5S
Molecular Weight:
311.3702
MDL Number:
MFCD24536393
IUPAC Name:
tert-butyl 3-fluoro-4-(methylsulfonyloxymethyl)piperidine-1-carboxylate
InChI:
InChI=1S/C12H22FNO5S/c1-12(2,3)19-11(15)14-6-5-9(10(13)7-14)8-18-20(4,16)17/h9-10H,5-8H2,1-4H3
InChI Key:
DVADQFSVWWQVQN-UHFFFAOYSA-N
SMILES:
FC1CN(CCC1COS(=O)(=O)C)C(=O)OC(C)(C)C
Properties
Complexity:
440  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.12g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.368g/mol
Monoisotopic Mass:
311.12g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
81.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties