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1240590-31-1 | 2-Piperazinecarboxylic acid, 5-oxo-, (2R)-
CAS No: 1240590-31-1 Catalog No: AG000LHI MDL No:
Product Description
Catalog Number:
AG000LHI
Chemical Name:
2-Piperazinecarboxylic acid, 5-oxo-, (2R)-
CAS Number:
1240590-31-1
Molecular Formula:
C5H8N2O3
Molecular Weight:
144.1286
IUPAC Name:
(2R)-5-oxopiperazine-2-carboxylic acid
InChI:
InChI=1S/C5H8N2O3/c8-4-2-6-3(1-7-4)5(9)10/h3,6H,1-2H2,(H,7,8)(H,9,10)/t3-/m1/s1
InChI Key:
CJFBRFWMGHQBFJ-GSVOUGTGSA-N
SMILES:
O=C1CN[C@H](CN1)C(=O)O
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
144.053g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
144.13g/mol
Monoisotopic Mass:
144.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.7
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