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Home > Other Heterocycles > 113769-00-9
113769-00-9 | 5,8,15,20-Tetraoxa-1,12-diazabicyclo[10.5.5]docosane-3,10-diol
CAS No: 113769-00-9 Catalog No: AG0009LU MDL No:
Product Description
Catalog Number:
AG0009LU
Chemical Name:
5,8,15,20-Tetraoxa-1,12-diazabicyclo[10.5.5]docosane-3,10-diol
CAS Number:
113769-00-9
Molecular Formula:
C16H32N2O6
Molecular Weight:
348.4351
IUPAC Name:
5,8,15,20-tetraoxa-1,12-diazabicyclo[10.5.5]docosane-3,10-diol
InChI:
InChI=1S/C16H32N2O6/c19-15-11-17-1-5-21-7-3-18(4-8-22-6-2-17)12-16(20)14-24-10-9-23-13-15/h15-16,19-20H,1-14H2
InChI Key:
VDGIJNTWFXPAJE-UHFFFAOYSA-N
SMILES:
OC1COCCOCC(O)CN2CCOCCN(C1)CCOCC2
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.226g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
348.44g/mol
Monoisotopic Mass:
348.226g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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