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114362-34-4

114362-34-4 | Piperazine, 2,5-bis(2-methylpropyl)-, trans- (9CI)

CAS No: 114362-34-4 Catalog No: AG000B5K MDL No:

Product Description

Catalog Number:
AG000B5K
Chemical Name:
Piperazine, 2,5-bis(2-methylpropyl)-, trans- (9CI)
CAS Number:
114362-34-4
Molecular Formula:
C12H26N2
Molecular Weight:
198.3482
IUPAC Name:
(2R,5S)-2,5-bis(2-methylpropyl)piperazine
InChI:
InChI=1S/C12H26N2/c1-9(2)5-11-7-14-12(8-13-11)6-10(3)4/h9-14H,5-8H2,1-4H3/t11-,12+
InChI Key:
PCIZNFXJQOGTNN-TXEJJXNPSA-N
SMILES:
CC(C[C@@H]1NC[C@H](NC1)CC(C)C)C

Properties

Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
198.21g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
198.354g/mol
Monoisotopic Mass:
198.21g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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