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128502-58-9 | Benzene, (8-iodooctyl)-
CAS No: 128502-58-9 Catalog No: AG000Y5N MDL No:
Product Description
Catalog Number:
AG000Y5N
Chemical Name:
Benzene, (8-iodooctyl)-
CAS Number:
128502-58-9
Molecular Formula:
C14H21I
Molecular Weight:
316.2210
IUPAC Name:
8-iodooctylbenzene
InChI:
InChI=1S/C14H21I/c15-13-9-4-2-1-3-6-10-14-11-7-5-8-12-14/h5,7-8,11-12H,1-4,6,9-10,13H2
InChI Key:
IXXBWKINNDDVLY-UHFFFAOYSA-N
SMILES:
ICCCCCCCCc1ccccc1
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.226g/mol
Monoisotopic Mass:
316.069g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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