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1286281-32-0 | 4,7,10,13,16,19-Hexaoxaheneicosanoic acid, 21-amino-, 1,1-dimethylethyl ester
CAS No: 1286281-32-0 Catalog No: AG000Y8L MDL No:MFCD13184944
Product Description
Catalog Number:
AG000Y8L
Chemical Name:
4,7,10,13,16,19-Hexaoxaheneicosanoic acid, 21-amino-, 1,1-dimethylethyl ester
CAS Number:
1286281-32-0
Molecular Formula:
C19H39NO8
Molecular Weight:
409.5149
MDL Number:
MFCD13184944
IUPAC Name:
tert-butyl 3-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
InChI:
InChI=1S/C19H39NO8/c1-19(2,3)28-18(21)4-6-22-8-10-24-12-14-26-16-17-27-15-13-25-11-9-23-7-5-20/h4-17,20H2,1-3H3
InChI Key:
QGSFECNPSLZGGT-UHFFFAOYSA-N
SMILES:
NCCOCCOCCOCCOCCOCCOCCC(=O)OC(C)(C)C
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
409.268g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
409.52g/mol
Monoisotopic Mass:
409.268g/mol
Rotatable Bond Count:
22
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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