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Home > Other Heterocycles > 19740-15-9
19740-15-9 | Bicyclo[2.2.1]hept-5-en-2-one, 6-methyl-
CAS No: 19740-15-9 Catalog No: AG002AT9 MDL No:
Product Description
Catalog Number:
AG002AT9
Chemical Name:
Bicyclo[2.2.1]hept-5-en-2-one, 6-methyl-
CAS Number:
19740-15-9
Molecular Formula:
C8H10O
Molecular Weight:
122.1644
IUPAC Name:
6-methylbicyclo[2.2.1]hept-5-en-2-one
InChI:
InChI=1S/C8H10O/c1-5-2-6-3-7(5)8(9)4-6/h2,6-7H,3-4H2,1H3
InChI Key:
VIWKRBHLQQYNIP-UHFFFAOYSA-N
SMILES:
O=C1CC2CC1C(=C2)C
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.073g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.167g/mol
Monoisotopic Mass:
122.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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