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26433-43-2 | 4,6-Methanocyclopenta[b]pyran-2(3H)-one, hexahydro-
CAS No: 26433-43-2 Catalog No: AG002T7I MDL No:
Product Description
Catalog Number:
AG002T7I
Chemical Name:
4,6-Methanocyclopenta[b]pyran-2(3H)-one, hexahydro-
CAS Number:
26433-43-2
Molecular Formula:
C9H12O2
Molecular Weight:
152.1904
IUPAC Name:
4-oxatricyclo[5.2.1.03,8]decan-5-one
InChI:
InChI=1S/C9H12O2/c10-9-4-6-1-5-2-7(6)8(3-5)11-9/h5-8H,1-4H2
InChI Key:
OJRFFNMKNICIGG-UHFFFAOYSA-N
SMILES:
O=C1CC2CC3CC(O1)C2C3
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.193g/mol
Monoisotopic Mass:
152.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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