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2060032-66-6 | 7-(iodomethyl)-6-oxaspiro[3.4]octan-2-one
CAS No: 2060032-66-6 Catalog No: AG01BRDU MDL No:MFCD30502487
Product Description
Catalog Number:
AG01BRDU
Chemical Name:
7-(iodomethyl)-6-oxaspiro[3.4]octan-2-one
CAS Number:
2060032-66-6
Molecular Formula:
C8H11IO2
Molecular Weight:
266.0762
MDL Number:
MFCD30502487
IUPAC Name:
7-(iodomethyl)-6-oxaspiro[3.4]octan-2-one
InChI:
InChI=1S/C8H11IO2/c9-4-7-3-8(5-11-7)1-6(10)2-8/h7H,1-5H2
InChI Key:
VWTKDIGVQWEWTF-UHFFFAOYSA-N
SMILES:
ICC1OCC2(C1)CC(=O)C2
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.98g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.078g/mol
Monoisotopic Mass:
265.98g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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