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1935986-52-9 | 1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane
CAS No: 1935986-52-9 Catalog No: AG01C332 MDL No:MFCD30486521
Product Description
Catalog Number:
AG01C332
Chemical Name:
1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane
CAS Number:
1935986-52-9
Molecular Formula:
C6H9IO
Molecular Weight:
224.0395
MDL Number:
MFCD30486521
IUPAC Name:
1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane
InChI:
InChI=1S/C6H9IO/c7-4-6-1-5(2-6)3-8-6/h5H,1-4H2
InChI Key:
SWEMXCZSPLYNSF-UHFFFAOYSA-N
SMILES:
ICC12OCC(C1)C2
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.97g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.041g/mol
Monoisotopic Mass:
223.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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