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Home > Other Heterocycles > 80722-28-7
80722-28-7 | 2,6,10,10-Tetramethyl-1-oxaspiro(4.5)dec-6-en-8-one
CAS No: 80722-28-7 Catalog No: AG005JRI MDL No:
Product Description
Catalog Number:
AG005JRI
Chemical Name:
2,6,10,10-Tetramethyl-1-oxaspiro(4.5)dec-6-en-8-one
CAS Number:
80722-28-7
Molecular Formula:
C13H20O2
Molecular Weight:
208.2967
IUPAC Name:
2,6,6,10-tetramethyl-1-oxaspiro[4.5]deca-2,9-dien-8-one
InChI:
InChI=1S/C13H18O2/c1-9-7-11(14)8-12(3,4)13(9)6-5-10(2)15-13/h5,7H,6,8H2,1-4H3
InChI Key:
PYBOFDINXIGETR-UHFFFAOYSA-N
SMILES:
CC1CCC2(O1)C(=CC(=O)CC2(C)C)C
EC Number:
279-534-3
FEMA Number:
4662
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.285g/mol
Monoisotopic Mass:
206.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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