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Home > Other Heterocycles > 121455-52-5
121455-52-5 | Bicyclo[4.2.2]decan-2-one, 1-hydroxy-
CAS No: 121455-52-5 Catalog No: AG001503 MDL No:
Product Description
Catalog Number:
AG001503
Chemical Name:
Bicyclo[4.2.2]decan-2-one, 1-hydroxy-
CAS Number:
121455-52-5
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
IUPAC Name:
1-hydroxybicyclo[4.2.2]decan-2-one
InChI:
InChI=1S/C10H16O2/c11-9-3-1-2-8-4-6-10(9,12)7-5-8/h8,12H,1-7H2
InChI Key:
IIMLTJMWDZEGSL-UHFFFAOYSA-N
SMILES:
O=C1CCCC2CCC1(O)CC2
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.236g/mol
Monoisotopic Mass:
168.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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