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Home > Other Building Blocks > 79688-26-9
79688-26-9 | 1,4,7,10,16,19-Hexaoxa-13,22-diazacyclotetracosane-14,17,21-trione
CAS No: 79688-26-9 Catalog No: AG00579I MDL No:
Product Description
Catalog Number:
AG00579I
Chemical Name:
1,4,7,10,16,19-Hexaoxa-13,22-diazacyclotetracosane-14,17,21-trione
CAS Number:
79688-26-9
Molecular Formula:
C16H28N2O9
Molecular Weight:
392.4015
IUPAC Name:
1,4,7,10,16,19-hexaoxa-13,22-diazacyclotetracosane-14,17,21-trione
InChI:
InChI=1S/C16H28N2O9/c19-14-11-26-13-16(21)27-12-15(20)18-2-4-23-6-8-25-10-9-24-7-5-22-3-1-17-14/h1-13H2,(H,17,19)(H,18,20)
InChI Key:
HHZPPMUBPWXBHC-UHFFFAOYSA-N
SMILES:
O=C1NCCOCCOCCOCCOCCNC(=O)COC(=O)COC1
Properties
Complexity:
434
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.179g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
392.405g/mol
Monoisotopic Mass:
392.179g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
131A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.1
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