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Home > Other Heterocycles > 96236-08-7
96236-08-7 | 2,3-Dioxabicyclo[2.2.1]hept-5-ene, 1,4-dimethyl-
CAS No: 96236-08-7 Catalog No: AG0068B7 MDL No:
Product Description
Catalog Number:
AG0068B7
Chemical Name:
2,3-Dioxabicyclo[2.2.1]hept-5-ene, 1,4-dimethyl-
CAS Number:
96236-08-7
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
IUPAC Name:
1,4-dimethyl-2,3-dioxabicyclo[2.2.1]hept-5-ene
InChI:
InChI=1S/C7H10O2/c1-6-3-4-7(2,5-6)9-8-6/h3-4H,5H2,1-2H3
InChI Key:
FCCKWRAJBLFXGV-UHFFFAOYSA-N
SMILES:
CC12OOC(C2)(C=C1)C
Properties
Complexity:
158
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:
0.9
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