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138510-58-4 | 1,3-Propanediamine, N1-[3-[(2-undecylpentadecyl)oxy]propyl]-
CAS No: 138510-58-4 Catalog No: AG0019CY MDL No:
Product Description
Catalog Number:
AG0019CY
Chemical Name:
1,3-Propanediamine, N1-[3-[(2-undecylpentadecyl)oxy]propyl]-
CAS Number:
138510-58-4
Molecular Formula:
C32H68N2O
Molecular Weight:
496.8951
IUPAC Name:
N'-[3-(2-undecylpentadecoxy)propyl]propane-1,3-diamine
InChI:
InChI=1S/C32H68N2O/c1-3-5-7-9-11-13-14-16-18-20-22-26-32(31-35-30-24-29-34-28-23-27-33)25-21-19-17-15-12-10-8-6-4-2/h32,34H,3-31,33H2,1-2H3
InChI Key:
XHYGKJQVHOQJSW-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCC(COCCCNCCCN)CCCCCCCCCCC
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
496.533g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
496.909g/mol
Monoisotopic Mass:
496.533g/mol
Rotatable Bond Count:
31
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
12.3
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