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126572-74-5 | Acetamide, 2-[2-(dicyclohexylamino)-2-oxoethoxy]-N,N-dioctadecyl-
CAS No: 126572-74-5 Catalog No: AG000SY1 MDL No:
Product Description
Catalog Number:
AG000SY1
Chemical Name:
Acetamide, 2-[2-(dicyclohexylamino)-2-oxoethoxy]-N,N-dioctadecyl-
CAS Number:
126572-74-5
Molecular Formula:
C52H100N2O3
Molecular Weight:
801.3620
IUPAC Name:
2-[2-(dicyclohexylamino)-2-oxoethoxy]-N,N-dioctadecylacetamide
InChI:
InChI=1S/C52H100N2O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-39-45-53(46-40-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)51(55)47-57-48-52(56)54(49-41-35-33-36-42-49)50-43-37-34-38-44-50/h49-50H,3-48H2,1-2H3
InChI Key:
CLLKVTAGSOWKHA-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCN(C(=O)COCC(=O)N(C1CCCCC1)C1CCCCC1)CCCCCCCCCCCCCCCCCC
Properties
Complexity:
829
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
800.773g/mol
Formal Charge:
0
Heavy Atom Count:
57
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
801.383g/mol
Monoisotopic Mass:
800.773g/mol
Rotatable Bond Count:
40
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
20.4
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