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Home > Other Heterocycles > 159277-40-4
159277-40-4 | 2,2'-Bibicyclo[2.2.2]oct-2-ene
CAS No: 159277-40-4 Catalog No: AG001QLA MDL No:
Product Description
Catalog Number:
AG001QLA
Chemical Name:
2,2'-Bibicyclo[2.2.2]oct-2-ene
CAS Number:
159277-40-4
Molecular Formula:
C16H24
Molecular Weight:
216.3618
IUPAC Name:
2-(2-bicyclo[2.2.2]oct-2-enyl)bicyclo[2.2.2]oct-2-ene
InChI:
InChI=1S/C16H22/c1-5-13-6-2-11(1)9-15(13)16-10-12-3-7-14(16)8-4-12/h9-14H,1-8H2
InChI Key:
XRQKXQTVFBLNLM-UHFFFAOYSA-N
SMILES:
C1CC2CCC1CC2C1=CC2CCC1CC2
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.172g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.352g/mol
Monoisotopic Mass:
214.172g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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