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Home > Other Heterocycles > 109459-57-6
109459-57-6 | 1,4-Dioxaspiro[4.4]nonan-7-ol
CAS No: 109459-57-6 Catalog No: AG00HBI2 MDL No:
Product Description
Catalog Number:
AG00HBI2
Chemical Name:
1,4-Dioxaspiro[4.4]nonan-7-ol
CAS Number:
109459-57-6
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
IUPAC Name:
1,4-dioxaspiro[4.4]nonan-8-ol
InChI:
InChI=1S/C7H12O3/c8-6-1-2-7(5-6)9-3-4-10-7/h6,8H,1-5H2
InChI Key:
GIFUGOIZRIPGPS-UHFFFAOYSA-N
SMILES:
OC1CCC2(C1)OCCO2
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.17g/mol
Monoisotopic Mass:
144.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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