Home Sulfos 3-(Piperidine-1-sulfonyl)benzylamine

3-(Piperidine-1-sulfonyl)benzylamine

CAS No.:
848813-81-0
Catalog Number:
AG00GLT8
Molecular Formula:
C12H18N2O2S
Molecular Weight:
254.3485
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Product Description
Catalog Number:
AG00GLT8
Chemical Name:
3-(Piperidine-1-sulfonyl)benzylamine
CAS Number:
848813-81-0
Molecular Formula:
C12H18N2O2S
Molecular Weight:
254.3485
MDL Number:
MFCD09736168
IUPAC Name:
(3-piperidin-1-ylsulfonylphenyl)methanamine
InChI:
InChI=1S/C12H18N2O2S/c13-10-11-5-4-6-12(9-11)17(15,16)14-7-2-1-3-8-14/h4-6,9H,1-3,7-8,10,13H2
InChI Key:
CHDVLTXVOJUOJL-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)S(=O)(=O)N1CCCCC1
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.109g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.348g/mol
Monoisotopic Mass:
254.109g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties