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Home > Other Heterocycles > 84963-17-7
84963-17-7 | Bicyclo[7.2.0]undecan-3-one,2,6,10,10-tetramethyl-
CAS No: 84963-17-7 Catalog No: AG0052F5 MDL No:
Product Description
Catalog Number:
AG0052F5
Chemical Name:
Bicyclo[7.2.0]undecan-3-one,2,6,10,10-tetramethyl-
CAS Number:
84963-17-7
Molecular Formula:
C15H26O
Molecular Weight:
222.3663
IUPAC Name:
2,6,10,10-tetramethylbicyclo[7.2.0]undecan-3-one
InChI:
InChI=1S/C15H26O/c1-10-5-7-13-12(9-15(13,3)4)11(2)14(16)8-6-10/h10-13H,5-9H2,1-4H3
InChI Key:
QZGLJLUOIMQJAQ-UHFFFAOYSA-N
SMILES:
CC1CCC(=O)C(C2C(CC1)C(C2)(C)C)C
EC Number:
284-818-5
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.198g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.372g/mol
Monoisotopic Mass:
222.198g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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