Home Other Building Blocks Benzoic acid,4-(1-piperazinyl)-

Benzoic acid,4-(1-piperazinyl)-

CAS No.:
85474-75-5
Catalog Number:
AG004NAA
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
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Product Description
Catalog Number:
AG004NAA
Chemical Name:
Benzoic acid,4-(1-piperazinyl)-
CAS Number:
85474-75-5
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
MDL Number:
MFCD03444417
IUPAC Name:
4-piperazin-1-ylbenzoic acid
InChI:
InChI=1S/C11H14N2O2/c14-11(15)9-1-3-10(4-2-9)13-7-5-12-6-8-13/h1-4,12H,5-8H2,(H,14,15)
InChI Key:
IAGYKSQGLCAAAD-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)N1CCNCC1
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6  
Properties