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Home > Other Heterocycles > 115077-66-2
115077-66-2 | 1,6-Dioxadispiro[4.1.5.1]trideca-8,11-diene-2,10-dione
CAS No: 115077-66-2 Catalog No: AG000FVT MDL No:
Product Description
Catalog Number:
AG000FVT
Chemical Name:
1,6-Dioxadispiro[4.1.5.1]trideca-8,11-diene-2,10-dione
CAS Number:
115077-66-2
Molecular Formula:
C11H10O4
Molecular Weight:
206.1947
IUPAC Name:
4,13-dioxadispiro[4.1.57.15]trideca-8,11-diene-3,10-dione
InChI:
InChI=1S/C11H10O4/c12-8-1-4-10(5-2-8)7-11(15-10)6-3-9(13)14-11/h1-2,4-5H,3,6-7H2
InChI Key:
CAZSBBDSSNQJGI-UHFFFAOYSA-N
SMILES:
O=C1C=CC2(C=C1)CC1(O2)CCC(=O)O1
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.058g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.197g/mol
Monoisotopic Mass:
206.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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