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Home > Other Heterocycles > 1690338-28-3
1690338-28-3 | 2,8-dioxaspiro[4.5]decan-1-one
CAS No: 1690338-28-3 Catalog No: AG01AF66 MDL No:MFCD26936287
Product Description
Catalog Number:
AG01AF66
Chemical Name:
2,8-dioxaspiro[4.5]decan-1-one
CAS Number:
1690338-28-3
Molecular Formula:
C8H12O3
Molecular Weight:
156.1791
MDL Number:
MFCD26936287
IUPAC Name:
2,8-dioxaspiro[4.5]decan-1-one
InChI:
InChI=1S/C8H12O3/c9-7-8(3-6-11-7)1-4-10-5-2-8/h1-6H2
InChI Key:
APIPWCNIYUXQKS-UHFFFAOYSA-N
SMILES:
O=C1OCCC21CCOCC2
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.181g/mol
Monoisotopic Mass:
156.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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