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Home > Other Heterocycles > 101999-73-9
101999-73-9 | Bicyclo[7.2.2]tridec-9(13)-ene
CAS No: 101999-73-9 Catalog No: AG00067A MDL No:
Product Description
Catalog Number:
AG00067A
Chemical Name:
Bicyclo[7.2.2]tridec-9(13)-ene
CAS Number:
101999-73-9
Molecular Formula:
C13H22
Molecular Weight:
178.3138
IUPAC Name:
bicyclo[7.2.2]tridec-1(11)-ene
InChI:
InChI=1S/C13H22/c1-2-4-6-12-8-10-13(11-9-12)7-5-3-1/h8,13H,1-7,9-11H2
InChI Key:
KURVFOYIVYPOSK-UHFFFAOYSA-N
SMILES:
C1CCCC2CCC(=CC2)CCC1
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.172g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.319g/mol
Monoisotopic Mass:
178.172g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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