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1279049-70-5

1279049-70-5 | 2,3-Piperazinedicarboxylic acid, 2,3-diethyl ester, (2R,3R)-

CAS No: 1279049-70-5 Catalog No: AG000XJL MDL No:

Product Description

Catalog Number:
AG000XJL
Chemical Name:
2,3-Piperazinedicarboxylic acid, 2,3-diethyl ester, (2R,3R)-
CAS Number:
1279049-70-5
Molecular Formula:
C10H18N2O4
Molecular Weight:
230.2609
IUPAC Name:
diethyl (2R,3R)-piperazine-2,3-dicarboxylate
InChI:
InChI=1S/C10H18N2O4/c1-3-15-9(13)7-8(10(14)16-4-2)12-6-5-11-7/h7-8,11-12H,3-6H2,1-2H3/t7-,8-/m1/s1
InChI Key:
JJNSKDRGNWNBSR-HTQZYQBOSA-N
SMILES:
CCOC(=O)[C@@H]1NCCN[C@H]1C(=O)OCC

Properties

Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
230.127g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.264g/mol
Monoisotopic Mass:
230.127g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  

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