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Home > Other Heterocycles > 2060009-21-2
2060009-21-2 | 3-oxaspiro[bicyclo[5.1.0]octane-4,4'-oxane]
CAS No: 2060009-21-2 Catalog No: AG01BZO5 MDL No:MFCD30488769
Product Description
Catalog Number:
AG01BZO5
Chemical Name:
3-oxaspiro[bicyclo[5.1.0]octane-4,4'-oxane]
CAS Number:
2060009-21-2
Molecular Formula:
C11H18O2
Molecular Weight:
182.2594
MDL Number:
MFCD30488769
IUPAC Name:
spiro[3-oxabicyclo[5.1.0]octane-4,4'-oxane]
InChI:
InChI=1S/C11H18O2/c1-2-11(3-5-12-6-4-11)13-8-10-7-9(1)10/h9-10H,1-8H2
InChI Key:
GRYYRPMZCCQYRL-UHFFFAOYSA-N
SMILES:
O1CCC2(CC1)CCC1C(CO2)C1
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.263g/mol
Monoisotopic Mass:
182.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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