Home Carboxys 2-Piperazinecarboxylic acid, 5-oxo-, methyl ester, (2S)-

2-Piperazinecarboxylic acid, 5-oxo-, methyl ester, (2S)-

CAS No.:
1191885-41-2
Catalog Number:
AG000IAA
Molecular Formula:
C6H10N2O3
Molecular Weight:
158.1552
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Product Description
Catalog Number:
AG000IAA
Chemical Name:
2-Piperazinecarboxylic acid, 5-oxo-, methyl ester, (2S)-
CAS Number:
1191885-41-2
Molecular Formula:
C6H10N2O3
Molecular Weight:
158.1552
MDL Number:
MFCD13186761
IUPAC Name:
methyl (2S)-5-oxopiperazine-2-carboxylate
InChI:
InChI=1S/C6H10N2O3/c1-11-6(10)4-2-8-5(9)3-7-4/h4,7H,2-3H2,1H3,(H,8,9)/t4-/m0/s1
InChI Key:
KLAVLUWNPFSXTG-BYPYZUCNSA-N
SMILES:
COC(=O)[C@@H]1CNC(=O)CN1
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
158.069g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
158.157g/mol
Monoisotopic Mass:
158.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1  
Properties