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Home > Other Heterocycles > 78804-73-6
78804-73-6 | 2-methylidene-4-oxabicyclo[3.3.0]oct-6-en-3-one
CAS No: 78804-73-6 Catalog No: AG0055CL MDL No:
Product Description
Catalog Number:
AG0055CL
Chemical Name:
2-methylidene-4-oxabicyclo[3.3.0]oct-6-en-3-one
CAS Number:
78804-73-6
Molecular Formula:
C8H8O2
Molecular Weight:
136.1479
IUPAC Name:
3-methylidene-4,6a-dihydro-3aH-cyclopenta[b]furan-2-one
InChI:
InChI=1S/C8H8O2/c1-5-6-3-2-4-7(6)10-8(5)9/h2,4,6-7H,1,3H2
InChI Key:
YJZSCBNXFHQEHK-UHFFFAOYSA-N
SMILES:
O=C1OC2C(C1=C)CC=C2
NSC Number:
324590
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.052g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.15g/mol
Monoisotopic Mass:
136.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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