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823-08-5 | 1,4-Dioxane, 2-ethenyl-
CAS No: 823-08-5 Catalog No: AG004ZKN MDL No:
Product Description
Catalog Number:
AG004ZKN
Chemical Name:
1,4-Dioxane, 2-ethenyl-
CAS Number:
823-08-5
Molecular Formula:
C6H10O2
Molecular Weight:
114.1424
IUPAC Name:
2-ethenyl-1,4-dioxane
InChI:
InChI=1S/C6H10O2/c1-2-6-5-7-3-4-8-6/h2,6H,1,3-5H2
InChI Key:
WJCCNRRUTSLHLJ-UHFFFAOYSA-N
SMILES:
C=CC1COCCO1
Properties
Complexity:
80.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.068g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
114.144g/mol
Monoisotopic Mass:
114.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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