Home Aminos 4-(3-aminopiperidin-1-yl)benzoic acid dihydrochloride

4-(3-aminopiperidin-1-yl)benzoic acid dihydrochloride

CAS No.:
1909319-40-9
Catalog Number:
AG01C4KM
Molecular Formula:
C12H18Cl2N2O2
Molecular Weight:
293.1895
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Product Description
Catalog Number:
AG01C4KM
Chemical Name:
4-(3-aminopiperidin-1-yl)benzoic acid dihydrochloride
CAS Number:
1909319-40-9
Molecular Formula:
C12H18Cl2N2O2
Molecular Weight:
293.1895
MDL Number:
MFCD29763143
IUPAC Name:
4-(3-aminopiperidin-1-yl)benzoic acid;dihydrochloride
InChI:
InChI=1S/C12H16N2O2.2ClH/c13-10-2-1-7-14(8-10)11-5-3-9(4-6-11)12(15)16;;/h3-6,10H,1-2,7-8,13H2,(H,15,16);2*1H
InChI Key:
SXRSATGWIGCYBS-UHFFFAOYSA-N
SMILES:
NC1CCCN(C1)c1ccc(cc1)C(=O)O.Cl.Cl
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.075g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
293.188g/mol
Monoisotopic Mass:
292.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties