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82394-21-6 | Piperazine, 1,4-didodecyl-
CAS No: 82394-21-6 Catalog No: AG005BQH MDL No:
Product Description
Catalog Number:
AG005BQH
Chemical Name:
Piperazine, 1,4-didodecyl-
CAS Number:
82394-21-6
Molecular Formula:
C28H58N2
Molecular Weight:
422.7735
IUPAC Name:
1,4-didodecylpiperazine
InChI:
InChI=1S/C28H58N2/c1-3-5-7-9-11-13-15-17-19-21-23-29-25-27-30(28-26-29)24-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3
InChI Key:
AYMBWPSTENUSCR-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCN1CCN(CC1)CCCCCCCCCCCC
NSC Number:
28941
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
422.46g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
422.786g/mol
Monoisotopic Mass:
422.46g/mol
Rotatable Bond Count:
22
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
11.2
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