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2138222-34-9 | 5-(iodomethyl)-6-oxaspiro[3.4]octan-7-one
CAS No: 2138222-34-9 Catalog No: AG01ELY4 MDL No:MFCD31421738
Product Description
Catalog Number:
AG01ELY4
Chemical Name:
5-(iodomethyl)-6-oxaspiro[3.4]octan-7-one
CAS Number:
2138222-34-9
Molecular Formula:
C8H11IO2
Molecular Weight:
266.0762
MDL Number:
MFCD31421738
IUPAC Name:
5-(iodomethyl)-6-oxaspiro[3.4]octan-7-one
InChI:
InChI=1S/C8H11IO2/c9-5-6-8(2-1-3-8)4-7(10)11-6/h6H,1-5H2
InChI Key:
UYUVPGJSFCBNLX-UHFFFAOYSA-N
SMILES:
ICC1OC(=O)CC21CCC2
Properties
Complexity:
187
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:
2.1
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