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Home > Other Heterocycles > 78013-58-8
78013-58-8 | 1,7-Dioxaspiro[5.5]undec-2-ene
CAS No: 78013-58-8 Catalog No: AG005DPF MDL No:
Product Description
Catalog Number:
AG005DPF
Chemical Name:
1,7-Dioxaspiro[5.5]undec-2-ene
CAS Number:
78013-58-8
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
IUPAC Name:
1,7-dioxaspiro[5.5]undec-2-ene
InChI:
InChI=1S/C9H14O2/c1-3-7-10-9(5-1)6-2-4-8-11-9/h3,7H,1-2,4-6,8H2
InChI Key:
FZOYTBAOVIOBAN-UHFFFAOYSA-N
SMILES:
C1CCC2(OC1)CCC=CO2
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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