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Home > Other Heterocycles > 16623-94-2
16623-94-2 | 13,14,27,28-Tetraoxadispiro[11.2.11.2]octacosane
CAS No: 16623-94-2 Catalog No: AG001WLR MDL No:
Product Description
Catalog Number:
AG001WLR
Chemical Name:
13,14,27,28-Tetraoxadispiro[11.2.11.2]octacosane
CAS Number:
16623-94-2
Molecular Formula:
C24H44O4
Molecular Weight:
396.6038
IUPAC Name:
13,14,27,28-tetraoxadispiro[11.2.1115.212]octacosane
InChI:
InChI=1S/C24H44O4/c1-3-7-11-15-19-23(20-16-12-8-4-1)25-27-24(28-26-23)21-17-13-9-5-2-6-10-14-18-22-24/h1-22H2
InChI Key:
TWXMORFHUQIFII-UHFFFAOYSA-N
SMILES:
C1CCCCCCCCCC2(C1)OOC1(OO2)CCCCCCCCCCC1
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.324g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
396.612g/mol
Monoisotopic Mass:
396.324g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.7
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