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Home > Other Heterocycles > 2138397-15-4
2138397-15-4 | 1,7-dioxaspiro[4.4]nonan-4-one
CAS No: 2138397-15-4 Catalog No: AG01EJYU MDL No:MFCD31448543
Product Description
Catalog Number:
AG01EJYU
Chemical Name:
1,7-dioxaspiro[4.4]nonan-4-one
CAS Number:
2138397-15-4
Molecular Formula:
C7H10O3
Molecular Weight:
142.1525
MDL Number:
MFCD31448543
IUPAC Name:
1,7-dioxaspiro[4.4]nonan-4-one
InChI:
InChI=1S/C7H10O3/c8-6-1-3-10-7(6)2-4-9-5-7/h1-5H2
InChI Key:
OZEINQPJJSBZIF-UHFFFAOYSA-N
SMILES:
O=C1CCOC21COCC2
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.063g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.154g/mol
Monoisotopic Mass:
142.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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