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80778-47-8 | Benzene, 1-iodo-2-(methoxymethoxy)-
CAS No: 80778-47-8 Catalog No: AG005J90 MDL No:
Product Description
Catalog Number:
AG005J90
Chemical Name:
Benzene, 1-iodo-2-(methoxymethoxy)-
CAS Number:
80778-47-8
Molecular Formula:
C8H9IO2
Molecular Weight:
264.0603
IUPAC Name:
1-iodo-2-(methoxymethoxy)benzene
InChI:
InChI=1S/C8H9IO2/c1-10-6-11-8-5-3-2-4-7(8)9/h2-5H,6H2,1H3
InChI Key:
KGARCSYHUWHUMQ-UHFFFAOYSA-N
SMILES:
COCOc1ccccc1I
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.965g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.062g/mol
Monoisotopic Mass:
263.965g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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