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Home > Other Heterocycles > 87829-76-3
87829-76-3 | 11,12,23,24-Tetraoxadispiro[9.2.9.2]tetracosane-5,18-dione
CAS No: 87829-76-3 Catalog No: AG004JNS MDL No:
Product Description
Catalog Number:
AG004JNS
Chemical Name:
11,12,23,24-Tetraoxadispiro[9.2.9.2]tetracosane-5,18-dione
CAS Number:
87829-76-3
Molecular Formula:
C20H32O6
Molecular Weight:
368.4645
IUPAC Name:
11,12,23,24-tetraoxadispiro[9.2.913.210]tetracosane-5,18-dione
InChI:
InChI=1S/C20H32O6/c21-17-9-1-5-13-19(14-6-2-10-17)23-25-20(26-24-19)15-7-3-11-18(22)12-4-8-16-20/h1-16H2
InChI Key:
HZDZXRKGXHJMQI-UHFFFAOYSA-N
SMILES:
O=C1CCCCC2(CCCC1)OOC1(OO2)CCCCC(=O)CCCC1
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.22g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.47g/mol
Monoisotopic Mass:
368.22g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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