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Home > Other Heterocycles > 17530-61-9
17530-61-9 | Bicyclo[3.3.1]non-1-ene
CAS No: 17530-61-9 Catalog No: AG0020WL MDL No:
Product Description
Catalog Number:
AG0020WL
Chemical Name:
Bicyclo[3.3.1]non-1-ene
CAS Number:
17530-61-9
Molecular Formula:
C9H14
Molecular Weight:
122.2075
IUPAC Name:
bicyclo[3.3.1]non-1-ene
InChI:
InChI=1S/C9H14/c1-3-8-5-2-6-9(4-1)7-8/h3,9H,1-2,4-7H2
InChI Key:
SIVKZPBURVINMX-UHFFFAOYSA-N
SMILES:
C1CC2CCC=C(C1)C2
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.11g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.211g/mol
Monoisotopic Mass:
122.11g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| Rhenium-catalyzed formation of bicyclo[3.3.1]nonene frameworks by a reaction of cyclic beta-keto esters with terminal alkynes. | Organic letters 20090618 |
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