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Home > Other Heterocycles > 13043-49-7
13043-49-7 | 1,4,6-Trioxaspiro[4.6]undecane (8CI,9CI)
CAS No: 13043-49-7 Catalog No: AG000UFA MDL No:
Product Description
Catalog Number:
AG000UFA
Chemical Name:
1,4,6-Trioxaspiro[4.6]undecane (8CI,9CI)
CAS Number:
13043-49-7
Molecular Formula:
C8H14O3
Molecular Weight:
158.1950
IUPAC Name:
1,4,11-trioxaspiro[4.6]undecane
InChI:
InChI=1S/C8H14O3/c1-2-4-8(9-5-3-1)10-6-7-11-8/h1-7H2
InChI Key:
LGWUNYGMMUPVHM-UHFFFAOYSA-N
SMILES:
C1CCOC2(CC1)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:
158.094g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.197g/mol
Monoisotopic Mass:
158.094g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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