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Home > Other Heterocycles > 88733-69-1
88733-69-1 | 1,4-Dioxaspiro[4.4]nonane, 6-[(phenylmethoxy)methyl]-
CAS No: 88733-69-1 Catalog No: AG0045IX MDL No:
Product Description
Catalog Number:
AG0045IX
Chemical Name:
1,4-Dioxaspiro[4.4]nonane, 6-[(phenylmethoxy)methyl]-
CAS Number:
88733-69-1
Molecular Formula:
C15H20O3
Molecular Weight:
248.3175
IUPAC Name:
9-(phenylmethoxymethyl)-1,4-dioxaspiro[4.4]nonane
InChI:
InChI=1S/C15H20O3/c1-2-5-13(6-3-1)11-16-12-14-7-4-8-15(14)17-9-10-18-15/h1-3,5-6,14H,4,7-12H2
InChI Key:
HDLLSQBZCGMFIO-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)COCC1CCCC21OCCO2
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.141g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.322g/mol
Monoisotopic Mass:
248.141g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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