Home Sulfos 1-(butane-1-sulfonyl)piperidine-2-carboxylic acid

1-(butane-1-sulfonyl)piperidine-2-carboxylic acid

CAS No.:
1105682-81-2
Catalog Number:
AG019LJQ
Molecular Formula:
C10H19NO4S
Molecular Weight:
249.3272
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Product Description
Catalog Number:
AG019LJQ
Chemical Name:
1-(butane-1-sulfonyl)piperidine-2-carboxylic acid
CAS Number:
1105682-81-2
Molecular Formula:
C10H19NO4S
Molecular Weight:
249.3272
MDL Number:
MFCD08442560
IUPAC Name:
1-butylsulfonylpiperidine-2-carboxylic acid
InChI:
InChI=1S/C10H19NO4S/c1-2-3-8-16(14,15)11-7-5-4-6-9(11)10(12)13/h9H,2-8H2,1H3,(H,12,13)
InChI Key:
KCQFZEBHMLIOAC-UHFFFAOYSA-N
SMILES:
CCCCS(=O)(=O)N1CCCCC1C(=O)O
Properties
Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.103g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.325g/mol
Monoisotopic Mass:
249.103g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties