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Home > Other Heterocycles > 89780-39-2
89780-39-2 | Bicyclo[3.3.1]nona-2,6-diene, 1,6-dimethyl-2-(2-propenyl)-
CAS No: 89780-39-2 Catalog No: AG004007 MDL No:
Product Description
Catalog Number:
AG004007
Chemical Name:
Bicyclo[3.3.1]nona-2,6-diene, 1,6-dimethyl-2-(2-propenyl)-
CAS Number:
89780-39-2
Molecular Formula:
C14H20
Molecular Weight:
188.3086
IUPAC Name:
1,6-dimethyl-2-prop-2-enylbicyclo[3.3.1]nona-2,6-diene
InChI:
InChI=1S/C14H20/c1-4-5-13-7-6-12-10-14(13,3)9-8-11(12)2/h4,7-8,12H,1,5-6,9-10H2,2-3H3
InChI Key:
JTVCWCLMDOESHA-UHFFFAOYSA-N
SMILES:
C=CCC1=CCC2CC1(C)CC=C2C
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.157g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.314g/mol
Monoisotopic Mass:
188.157g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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