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86360-42-1 | Piperazine, 1-butyl-4-(1,2-diphenylethyl)-
CAS No: 86360-42-1 Catalog No: AG004LZ7 MDL No:
Product Description
Catalog Number:
AG004LZ7
Chemical Name:
Piperazine, 1-butyl-4-(1,2-diphenylethyl)-
CAS Number:
86360-42-1
Molecular Formula:
C22H30N2
Molecular Weight:
322.4870
IUPAC Name:
1-butyl-4-(1,2-diphenylethyl)piperazine
InChI:
InChI=1S/C22H30N2/c1-2-3-14-23-15-17-24(18-16-23)22(21-12-8-5-9-13-21)19-20-10-6-4-7-11-20/h4-13,22H,2-3,14-19H2,1H3
InChI Key:
WKFWQHOCJJCCJC-UHFFFAOYSA-N
SMILES:
CCCCN1CCN(CC1)C(c1ccccc1)Cc1ccccc1
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.241g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.496g/mol
Monoisotopic Mass:
322.241g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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