Home Carboxys 1,2-Piperazinedicarboxylic acid, 1-(9H-fluoren-9-ylmethyl) ester

1,2-Piperazinedicarboxylic acid, 1-(9H-fluoren-9-ylmethyl) ester

CAS No.:
918435-70-8
Catalog Number:
AG006F3R
Molecular Formula:
C20H19N2O4-
Molecular Weight:
351.3759
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Product Description
Catalog Number:
AG006F3R
Chemical Name:
1,2-Piperazinedicarboxylic acid, 1-(9H-fluoren-9-ylmethyl) ester
CAS Number:
918435-70-8
Molecular Formula:
C20H19N2O4-
Molecular Weight:
351.3759
MDL Number:
MFCD02682404
IUPAC Name:
1-(9H-fluoren-9-ylmethoxycarbonyl)piperazine-2-carboxylic acid
InChI:
InChI=1S/C20H20N2O4/c23-19(24)18-11-21-9-10-22(18)20(25)26-12-17-15-7-3-1-5-13(15)14-6-2-4-8-16(14)17/h1-8,17-18,21H,9-12H2,(H,23,24)
InChI Key:
RKXKKKUNIBLRES-UHFFFAOYSA-N
SMILES:
[O-]C(=O)C1CNCCN1C(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
518  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.142g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
352.39g/mol
Monoisotopic Mass:
352.142g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties