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Home > Other Heterocycles > 14845-41-1
14845-41-1 | Bicyclo[4.1.0]heptan-2-one, 6-methyl-
CAS No: 14845-41-1 Catalog No: AG001KY1 MDL No:MFCD09866569
Product Description
Catalog Number:
AG001KY1
Chemical Name:
Bicyclo[4.1.0]heptan-2-one, 6-methyl-
CAS Number:
14845-41-1
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
MDL Number:
MFCD09866569
IUPAC Name:
6-methylbicyclo[4.1.0]heptan-2-one
InChI:
InChI=1S/C8H12O/c1-8-4-2-3-7(9)6(8)5-8/h6H,2-5H2,1H3
InChI Key:
UEILJFFGJJRFFG-UHFFFAOYSA-N
SMILES:
O=C1CCCC2(C1C2)C
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.089g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.183g/mol
Monoisotopic Mass:
124.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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