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1849359-21-2 | 6-(iodomethyl)-5-oxaspiro[3.4]octane
CAS No: 1849359-21-2 Catalog No: AG01BU7P MDL No:MFCD30724034
Product Description
Catalog Number:
AG01BU7P
Chemical Name:
6-(iodomethyl)-5-oxaspiro[3.4]octane
CAS Number:
1849359-21-2
Molecular Formula:
C8H13IO
Molecular Weight:
252.0927
MDL Number:
MFCD30724034
IUPAC Name:
6-(iodomethyl)-5-oxaspiro[3.4]octane
InChI:
InChI=1S/C8H13IO/c9-6-7-2-5-8(10-7)3-1-4-8/h7H,1-6H2
InChI Key:
VMYZCPNTCWXXOX-UHFFFAOYSA-N
SMILES:
ICC1CCC2(O1)CCC2
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.001g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.095g/mol
Monoisotopic Mass:
252.001g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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