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Home > Other Heterocycles > 68525-36-0
68525-36-0 | 6,7-Dioxabicyclo[3.2.2]non-2-ene
CAS No: 68525-36-0 Catalog No: AG006ITW MDL No:
Product Description
Catalog Number:
AG006ITW
Chemical Name:
6,7-Dioxabicyclo[3.2.2]non-2-ene
CAS Number:
68525-36-0
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
IUPAC Name:
6,7-dioxabicyclo[3.2.2]non-2-ene
InChI:
InChI=1S/C7H10O2/c1-2-6-4-5-7(3-1)9-8-6/h1-2,6-7H,3-5H2
InChI Key:
UYIGPXCIFJZRJL-UHFFFAOYSA-N
SMILES:
C1=CC2CCC(C1)OO2
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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