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Home > Other Heterocycles > 88635-76-1
88635-76-1 | 2,5,7,10-tetramethylbicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
CAS No: 88635-76-1 Catalog No: AG004BGV MDL No:
Product Description
Catalog Number:
AG004BGV
Chemical Name:
2,5,7,10-tetramethylbicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
CAS Number:
88635-76-1
Molecular Formula:
C15H18
Molecular Weight:
198.3034
IUPAC Name:
2,5,7,10-tetramethylbicyclo[4.4.1]undeca-1(10),2,4,6,8-pentaene
InChI:
InChI=1S/C15H18/c1-10-5-6-12(3)15-9-14(10)11(2)7-8-13(15)4/h5-8H,9H2,1-4H3
InChI Key:
QAUJABVXBCKCDL-UHFFFAOYSA-N
SMILES:
Cc1ccc(c2Cc1c(C)ccc2C)C
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.141g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.309g/mol
Monoisotopic Mass:
198.141g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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