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121587-83-5 | 1-Octene, 8-(1,1-dimethylethoxy)-1-iodo-, (1E)-
CAS No: 121587-83-5 Catalog No: AG0015C8 MDL No:
Product Description
Catalog Number:
AG0015C8
Chemical Name:
1-Octene, 8-(1,1-dimethylethoxy)-1-iodo-, (1E)-
CAS Number:
121587-83-5
Molecular Formula:
C12H23IO
Molecular Weight:
310.2149
IUPAC Name:
1-iodo-8-[(2-methylpropan-2-yl)oxy]oct-1-ene
InChI:
InChI=1S/C12H23IO/c1-12(2,3)14-11-9-7-5-4-6-8-10-13/h8,10H,4-7,9,11H2,1-3H3
InChI Key:
KXBONFWWYPKGQG-UHFFFAOYSA-N
SMILES:
I/C=C/CCCCCCOC(C)(C)C
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.219g/mol
Monoisotopic Mass:
310.079g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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