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Home > Other Heterocycles > 670275-58-8
670275-58-8 | 5-Oxaspiro[3.4]octan-2-one, 1,1-dimethyl-3-[(5-methyl-4-hexenyl)oxy]-
CAS No: 670275-58-8 Catalog No: AG005RDK MDL No:
Product Description
Catalog Number:
AG005RDK
Chemical Name:
5-Oxaspiro[3.4]octan-2-one, 1,1-dimethyl-3-[(5-methyl-4-hexenyl)oxy]-
CAS Number:
670275-58-8
Molecular Formula:
C16H26O3
Molecular Weight:
266.3758
IUPAC Name:
3,3-dimethyl-1-(5-methylhex-4-enoxy)-5-oxaspiro[3.4]octan-2-one
InChI:
InChI=1S/C16H26O3/c1-12(2)8-5-6-10-18-14-13(17)15(3,4)16(14)9-7-11-19-16/h8,14H,5-7,9-11H2,1-4H3
InChI Key:
HQAQKDUAFWVXOG-UHFFFAOYSA-N
SMILES:
CC(=CCCCOC1C(=O)C(C21CCCO2)(C)C)C
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.188g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.381g/mol
Monoisotopic Mass:
266.188g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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