Home Sulfos benzyl 4,4-dimethoxy-3-((methylsulfonyl)oxy)piperidine-1-carboxylate

benzyl 4,4-dimethoxy-3-((methylsulfonyl)oxy)piperidine-1-carboxylate

CAS No.:
1956306-17-4
Catalog Number:
AG01DFXZ
Molecular Formula:
C16H23NO7S
Molecular Weight:
373.4213
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Product Description
Catalog Number:
AG01DFXZ
Chemical Name:
benzyl 4,4-dimethoxy-3-((methylsulfonyl)oxy)piperidine-1-carboxylate
CAS Number:
1956306-17-4
Molecular Formula:
C16H23NO7S
Molecular Weight:
373.4213
MDL Number:
MFCD28991973
IUPAC Name:
benzyl 4,4-dimethoxy-3-methylsulfonyloxypiperidine-1-carboxylate
InChI:
InChI=1S/C16H23NO7S/c1-21-16(22-2)9-10-17(11-14(16)24-25(3,19)20)15(18)23-12-13-7-5-4-6-8-13/h4-8,14H,9-12H2,1-3H3
InChI Key:
DXPWJSDJWRMRPQ-UHFFFAOYSA-N
SMILES:
COC1(OC)CCN(CC1OS(=O)(=O)C)C(=O)OCc1ccccc1
Properties
Complexity:
535  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.12g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
373.42g/mol
Monoisotopic Mass:
373.12g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
99.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties