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Home > Other Heterocycles > 27723-43-9
27723-43-9 | Spiro[4.4]nonane-1,6-dione
CAS No: 27723-43-9 Catalog No: AG002UM4 MDL No:
Product Description
Catalog Number:
AG002UM4
Chemical Name:
Spiro[4.4]nonane-1,6-dione
CAS Number:
27723-43-9
Molecular Formula:
C9H12O2
Molecular Weight:
152.1904
IUPAC Name:
spiro[4.4]nonane-4,9-dione
InChI:
InChI=1S/C9H12O2/c10-7-3-1-5-9(7)6-2-4-8(9)11/h1-6H2
InChI Key:
PIOGLWMIXIMTAW-UHFFFAOYSA-N
SMILES:
O=C1CCCC21CCCC2=O
NSC Number:
314546
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.193g/mol
Monoisotopic Mass:
152.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
Literature
| Title | Journal |
|---|---|
| N-(4-Chloro-phen-yl)-4-(2-oxocyclo-pent-yl)butyramide. | Acta crystallographica. Section E, Structure reports online 20090101 |
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