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Home > Other Heterocycles > 5019-86-3
5019-86-3 | Bicyclo[3.2.1]oct-2-ene, 2-methyl-
CAS No: 5019-86-3 Catalog No: AG006VQL MDL No:
Product Description
Catalog Number:
AG006VQL
Chemical Name:
Bicyclo[3.2.1]oct-2-ene, 2-methyl-
CAS Number:
5019-86-3
Molecular Formula:
C9H14
Molecular Weight:
122.2075
IUPAC Name:
2-methylbicyclo[3.2.1]oct-2-ene
InChI:
InChI=1S/C9H14/c1-7-2-3-8-4-5-9(7)6-8/h2,8-9H,3-6H2,1H3
InChI Key:
PVYABQXOJMMRCS-UHFFFAOYSA-N
SMILES:
CC1=CCC2CC1CC2
Properties
Complexity:
144
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:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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