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89121-68-6 | Cyclopenta[b]pyran-6(2H)-one, hexahydro-7-methylene-, cis-
CAS No: 89121-68-6 Catalog No: AG003Y8G MDL No:
Product Description
Catalog Number:
AG003Y8G
Chemical Name:
Cyclopenta[b]pyran-6(2H)-one, hexahydro-7-methylene-, cis-
CAS Number:
89121-68-6
Molecular Formula:
C9H12O2
Molecular Weight:
152.1904
IUPAC Name:
(4aR,7aR)-7-methylidene-2,3,4,4a,5,7a-hexahydrocyclopenta[b]pyran-6-one
InChI:
InChI=1S/C9H12O2/c1-6-8(10)5-7-3-2-4-11-9(6)7/h7,9H,1-5H2/t7-,9+/m1/s1
InChI Key:
LEGFCNAESJVEBE-APPZFPTMSA-N
SMILES:
O=C1C[C@@H]2[C@H](C1=C)OCCC2
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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