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Home > Other Heterocycles > 88816-30-2
88816-30-2 | Bicyclo[4.4.1]undeca-1,5,8-triene, (Z,Z,Z)-
CAS No: 88816-30-2 Catalog No: AG004AQJ MDL No:
Product Description
Catalog Number:
AG004AQJ
Chemical Name:
Bicyclo[4.4.1]undeca-1,5,8-triene, (Z,Z,Z)-
CAS Number:
88816-30-2
Molecular Formula:
C11H14
Molecular Weight:
146.2289
IUPAC Name:
bicyclo[4.4.1]undeca-1,5,8-triene
InChI:
InChI=1S/C11H14/c1-2-6-11-8-4-3-7-10(5-1)9-11/h1-2,7-8H,3-6,9H2
InChI Key:
WISVDKQUZGBNBF-UHFFFAOYSA-N
SMILES:
C1CC=C2CC(=C1)CC=CC2
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.11g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.233g/mol
Monoisotopic Mass:
146.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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