Home Sulfos 1-(ethanesulfonyl)-4-phenylpiperidine-4-carboxylic acid

1-(ethanesulfonyl)-4-phenylpiperidine-4-carboxylic acid

CAS No.:
863669-55-0
Catalog Number:
AG019OJY
Molecular Formula:
C14H19NO4S
Molecular Weight:
297.3700
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Product Description
Catalog Number:
AG019OJY
Chemical Name:
1-(ethanesulfonyl)-4-phenylpiperidine-4-carboxylic acid
CAS Number:
863669-55-0
Molecular Formula:
C14H19NO4S
Molecular Weight:
297.3700
MDL Number:
MFCD07339173
IUPAC Name:
1-ethylsulfonyl-4-phenylpiperidine-4-carboxylic acid
InChI:
InChI=1S/C14H19NO4S/c1-2-20(18,19)15-10-8-14(9-11-15,13(16)17)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3,(H,16,17)
InChI Key:
LWZSKVIROIBLGI-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)N1CCC(CC1)(C(=O)O)c1ccccc1
Properties
Complexity:
440  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.103g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
297.369g/mol
Monoisotopic Mass:
297.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties