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2059939-74-9 | 7-(iodomethyl)-2-methyl-6-oxaspiro[3.4]octane
CAS No: 2059939-74-9 Catalog No: AG01BRE1 MDL No:MFCD30502494
Product Description
Catalog Number:
AG01BRE1
Chemical Name:
7-(iodomethyl)-2-methyl-6-oxaspiro[3.4]octane
CAS Number:
2059939-74-9
Molecular Formula:
C9H15IO
Molecular Weight:
266.1193
MDL Number:
MFCD30502494
IUPAC Name:
7-(iodomethyl)-2-methyl-6-oxaspiro[3.4]octane
InChI:
InChI=1S/C9H15IO/c1-7-2-9(3-7)4-8(5-10)11-6-9/h7-8H,2-6H2,1H3
InChI Key:
NYTUEMMYODHPQT-UHFFFAOYSA-N
SMILES:
ICC1OCC2(C1)CC(C2)C
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.017g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.122g/mol
Monoisotopic Mass:
266.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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