Home Other Building Blocks 4-(4-phenylpiperazin-1-yl)butanoic acid dihydrochloride

4-(4-phenylpiperazin-1-yl)butanoic acid dihydrochloride

CAS No.:
1258725-11-9
Catalog Number:
AG01ABE9
Molecular Formula:
C14H22Cl2N2O2
Molecular Weight:
321.2427
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Product Description
Catalog Number:
AG01ABE9
Chemical Name:
4-(4-phenylpiperazin-1-yl)butanoic acid dihydrochloride
CAS Number:
1258725-11-9
Molecular Formula:
C14H22Cl2N2O2
Molecular Weight:
321.2427
MDL Number:
MFCD18089389
IUPAC Name:
4-(4-phenylpiperazin-1-yl)butanoic acid;dihydrochloride
InChI:
InChI=1S/C14H20N2O2.2ClH/c17-14(18)7-4-8-15-9-11-16(12-10-15)13-5-2-1-3-6-13;;/h1-3,5-6H,4,7-12H2,(H,17,18);2*1H
InChI Key:
XLAWMIBNMKYCFV-UHFFFAOYSA-N
SMILES:
OC(=O)CCCN1CCN(CC1)c1ccccc1.Cl.Cl
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.106g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
321.242g/mol
Monoisotopic Mass:
320.106g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties