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Home > Other Heterocycles > 16473-12-4
16473-12-4 | Bicyclo[3.3.1]nonane-2,6-diol
CAS No: 16473-12-4 Catalog No: AG001V2M MDL No:
Product Description
Catalog Number:
AG001V2M
Chemical Name:
Bicyclo[3.3.1]nonane-2,6-diol
CAS Number:
16473-12-4
Molecular Formula:
C9H16O2
Molecular Weight:
156.2221
IUPAC Name:
bicyclo[3.3.1]nonane-2,6-diol
InChI:
InChI=1S/C9H16O2/c10-8-3-1-6-5-7(8)2-4-9(6)11/h6-11H,1-5H2
InChI Key:
ZAFAKOTZLSQTTI-UHFFFAOYSA-N
SMILES:
OC1CCC2CC1CCC2O
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.115g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
156.225g/mol
Monoisotopic Mass:
156.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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