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116430-64-9 | Piperazine, 1,1'-(1,6-dioxo-1,6-hexanediyl)bis[3,3,4,5,5-pentamethyl- (9CI)
CAS No: 116430-64-9 Catalog No: AG000CH2 MDL No:
Product Description
Catalog Number:
AG000CH2
Chemical Name:
Piperazine, 1,1'-(1,6-dioxo-1,6-hexanediyl)bis[3,3,4,5,5-pentamethyl- (9CI)
CAS Number:
116430-64-9
Molecular Formula:
C24H46N4O2
Molecular Weight:
422.6476
IUPAC Name:
1,6-bis(3,3,4,5,5-pentamethylpiperazin-1-yl)hexane-1,6-dione
InChI:
InChI=1S/C24H46N4O2/c1-21(2)15-27(16-22(3,4)25(21)9)19(29)13-11-12-14-20(30)28-17-23(5,6)26(10)24(7,8)18-28/h11-18H2,1-10H3
InChI Key:
HMHCZXDWGZPYBM-UHFFFAOYSA-N
SMILES:
CN1C(C)(C)CN(CC1(C)C)C(=O)CCCCC(=O)N1CC(C)(C)N(C(C1)(C)C)C
Properties
Complexity:
562
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
422.362g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
422.658g/mol
Monoisotopic Mass:
422.362g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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