Home Sulfos 1-[2-(4-bromobenzenesulfonyl)ethyl]piperidin-4-ol

1-[2-(4-bromobenzenesulfonyl)ethyl]piperidin-4-ol

CAS No.:
1000927-51-4
Catalog Number:
AG01AHXE
Molecular Formula:
C13H18BrNO3S
Molecular Weight:
348.2559
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Product Description
Catalog Number:
AG01AHXE
Chemical Name:
1-[2-(4-bromobenzenesulfonyl)ethyl]piperidin-4-ol
CAS Number:
1000927-51-4
Molecular Formula:
C13H18BrNO3S
Molecular Weight:
348.2559
MDL Number:
MFCD10591663
IUPAC Name:
1-[2-(4-bromophenyl)sulfonylethyl]piperidin-4-ol
InChI:
InChI=1S/C13H18BrNO3S/c14-11-1-3-13(4-2-11)19(17,18)10-9-15-7-5-12(16)6-8-15/h1-4,12,16H,5-10H2
InChI Key:
GCSFWYZYIYSMGG-UHFFFAOYSA-N
SMILES:
OC1CCN(CC1)CCS(=O)(=O)c1ccc(cc1)Br
Properties
Complexity:
366  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.019g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
348.255g/mol
Monoisotopic Mass:
347.019g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties