Home Sulfos piperidin-3-yl trifluoromethanesulfonate

piperidin-3-yl trifluoromethanesulfonate

CAS No.:
51036-12-5
Catalog Number:
AG00DJM1
Molecular Formula:
C5H11NO3S
Molecular Weight:
165.2107
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Product Description
Catalog Number:
AG00DJM1
Chemical Name:
piperidin-3-yl trifluoromethanesulfonate
CAS Number:
51036-12-5
Molecular Formula:
C5H11NO3S
Molecular Weight:
165.2107
MDL Number:
MFCD13179328
IUPAC Name:
piperidine-3-sulfonic acid
InChI:
InChI=1S/C5H11NO3S/c7-10(8,9)5-2-1-3-6-4-5/h5-6H,1-4H2,(H,7,8,9)
InChI Key:
JHRHBIGQXOSCLY-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)C1CCCNC1
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.046g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.207g/mol
Monoisotopic Mass:
165.046g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-3  
Literature
Title Journal
Inhibition of rabbit brain 4-aminobutyrate transaminase by some taurine analogues: a kinetic analysis. Biochemical pharmacology 20060514
GABA-mediated effects of some taurine derivatives injected i.c.v. on rabbit rectal temperature and gross motor behavior. Amino acids 20060501
Interactions of taurine and structurally related analogues with the GABAergic system and taurine binding sites of rabbit brain. British journal of pharmacology 20030301
Properties