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32865-61-5 | 1-ACETOXY-2-IODOBENZENE
CAS No: 32865-61-5 Catalog No: AG00C763 MDL No:MFCD07780625
Product Description
Catalog Number:
AG00C763
Chemical Name:
1-ACETOXY-2-IODOBENZENE
CAS Number:
32865-61-5
Molecular Formula:
C8H7IO2
Molecular Weight:
262.0445
MDL Number:
MFCD07780625
IUPAC Name:
(2-iodophenyl) acetate
InChI:
InChI=1S/C8H7IO2/c1-6(10)11-8-5-3-2-4-7(8)9/h2-5H,1H3
InChI Key:
SNIVHZRVLQLTLY-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccccc1I
EC Number:
608-794-6
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.949g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.046g/mol
Monoisotopic Mass:
261.949g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Total synthesis of anthocyanidins via Heck reaction. | Natural product research 20060101 |
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