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85098-99-3 | Decanamide,N,N'-1,2-ethanediylbis[2-hexyl-
CAS No: 85098-99-3 Catalog No: AG004XKD MDL No:
Product Description
Catalog Number:
AG004XKD
Chemical Name:
Decanamide,N,N'-1,2-ethanediylbis[2-hexyl-
CAS Number:
85098-99-3
Molecular Formula:
C34H68N2O2
Molecular Weight:
536.9159
IUPAC Name:
2-hexyl-N-[2-(2-hexyldecanoylamino)ethyl]decanamide
InChI:
InChI=1S/C34H68N2O2/c1-5-9-13-17-19-23-27-31(25-21-15-11-7-3)33(37)35-29-30-36-34(38)32(26-22-16-12-8-4)28-24-20-18-14-10-6-2/h31-32H,5-30H2,1-4H3,(H,35,37)(H,36,38)
InChI Key:
RMORRUPNCCULDO-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(C(=O)NCCNC(=O)C(CCCCCCCC)CCCCCC)CCCCCC
EC Number:
285-453-4
Properties
Complexity:
477
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
536.528g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
536.93g/mol
Monoisotopic Mass:
536.528g/mol
Rotatable Bond Count:
29
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
13.2
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