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Home > Other Heterocycles > 88718-32-5
88718-32-5 | 2,6,9,13-tetraoxabicyclo[12.4.0]octadeca-14,16,18-triene
CAS No: 88718-32-5 Catalog No: AG0045CZ MDL No:
Product Description
Catalog Number:
AG0045CZ
Chemical Name:
2,6,9,13-tetraoxabicyclo[12.4.0]octadeca-14,16,18-triene
CAS Number:
88718-32-5
Molecular Formula:
C14H20O4
Molecular Weight:
252.3062
IUPAC Name:
2,6,9,13-tetraoxabicyclo[12.4.0]octadeca-1(18),14,16-triene
InChI:
InChI=1S/C14H20O4/c1-2-6-14-13(5-1)17-9-3-7-15-11-12-16-8-4-10-18-14/h1-2,5-6H,3-4,7-12H2
InChI Key:
BZTWZGNJYJKCEM-UHFFFAOYSA-N
SMILES:
C1CCOc2ccccc2OCCCOCCO1
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.31g/mol
Monoisotopic Mass:
252.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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