Home Other Building Blocks 2-phenyl-2-(piperazin-1-yl)acetic acid

2-phenyl-2-(piperazin-1-yl)acetic acid

CAS No.:
328269-46-1
Catalog Number:
AG01A6P6
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
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Product Description
Catalog Number:
AG01A6P6
Chemical Name:
2-phenyl-2-(piperazin-1-yl)acetic acid
CAS Number:
328269-46-1
Molecular Formula:
C12H16N2O2
Molecular Weight:
220.2676
MDL Number:
MFCD12818027
IUPAC Name:
2-phenyl-2-piperazin-1-ylacetic acid
InChI:
InChI=1S/C12H16N2O2/c15-12(16)11(10-4-2-1-3-5-10)14-8-6-13-7-9-14/h1-5,11,13H,6-9H2,(H,15,16)
InChI Key:
BGORWWYTHPSHCC-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccccc1)N1CCNCC1
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.121g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
220.272g/mol
Monoisotopic Mass:
220.121g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4  
Properties