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918312-24-0 | 1,7-Dioxadispiro[4.0.4.2]dodecane-2,8-dione, 11,12-dimethyl-
CAS No: 918312-24-0 Catalog No: AG006GD4 MDL No:
Product Description
Catalog Number:
AG006GD4
Chemical Name:
1,7-Dioxadispiro[4.0.4.2]dodecane-2,8-dione, 11,12-dimethyl-
CAS Number:
918312-24-0
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
IUPAC Name:
11,12-dimethyl-4,7-dioxadispiro[4.0.46.25]dodecane-3,8-dione
InChI:
InChI=1S/C12H16O4/c1-7-8(2)12(6-4-10(14)16-12)11(7)5-3-9(13)15-11/h7-8H,3-6H2,1-2H3
InChI Key:
YVOJXYPHBGSLFA-UHFFFAOYSA-N
SMILES:
CC1C(C)C2(C31CCC(=O)O3)CCC(=O)O2
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.256g/mol
Monoisotopic Mass:
224.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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