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17768-64-8 | Piperazine, 1,4-bis[[4-(1,1-dimethylethyl)phenyl]methyl]-
CAS No: 17768-64-8 Catalog No: AG0025G5 MDL No:
Product Description
Catalog Number:
AG0025G5
Chemical Name:
Piperazine, 1,4-bis[[4-(1,1-dimethylethyl)phenyl]methyl]-
CAS Number:
17768-64-8
Molecular Formula:
C26H38N2
Molecular Weight:
378.5933
IUPAC Name:
1,4-bis[(4-tert-butylphenyl)methyl]piperazine
InChI:
InChI=1S/C26H38N2/c1-25(2,3)23-11-7-21(8-12-23)19-27-15-17-28(18-16-27)20-22-9-13-24(14-10-22)26(4,5)6/h7-14H,15-20H2,1-6H3
InChI Key:
PSRVWPSWGVQKTH-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)CN1CCN(CC1)Cc1ccc(cc1)C(C)(C)C)(C)C
NSC Number:
38662
Properties
Complexity:
404
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.303g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
378.604g/mol
Monoisotopic Mass:
378.303g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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