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16121-19-0 | Oxacycloundecane-2,8-dione
CAS No: 16121-19-0 Catalog No: AG001S9W MDL No:
Product Description
Catalog Number:
AG001S9W
Chemical Name:
Oxacycloundecane-2,8-dione
CAS Number:
16121-19-0
Molecular Formula:
C10H16O3
Molecular Weight:
184.2322
IUPAC Name:
oxacycloundecane-2,8-dione
InChI:
InChI=1S/C10H16O3/c11-9-5-2-1-3-7-10(12)13-8-4-6-9/h1-8H2
InChI Key:
LRNASRXWMRNIMS-UHFFFAOYSA-N
SMILES:
O=C1CCCOC(=O)CCCCC1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.11g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.235g/mol
Monoisotopic Mass:
184.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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