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Home > Other Heterocycles > 98506-58-2
98506-58-2 | Bicyclo[3.3.1]nonane-2,3-diol, 2,6,6-trimethyl-9-methylene-
CAS No: 98506-58-2 Catalog No: AG00682W MDL No:
Product Description
Catalog Number:
AG00682W
Chemical Name:
Bicyclo[3.3.1]nonane-2,3-diol, 2,6,6-trimethyl-9-methylene-
CAS Number:
98506-58-2
Molecular Formula:
C13H22O2
Molecular Weight:
210.3126
IUPAC Name:
2,6,6-trimethyl-9-methylidenebicyclo[3.3.1]nonane-2,3-diol
InChI:
InChI=1S/C13H22O2/c1-8-9-5-6-12(2,3)10(8)7-11(14)13(9,4)15/h9-11,14-15H,1,5-7H2,2-4H3
InChI Key:
NDZPXEMTGZWBCT-UHFFFAOYSA-N
SMILES:
C=C1C2CC(C(C1CCC2(C)C)(C)O)O
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.162g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.317g/mol
Monoisotopic Mass:
210.162g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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