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69180-50-3

69180-50-3 | BIS(ACETATO-O)(3-METHOXYPHENYL)IODINE

CAS No: 69180-50-3 Catalog No: AG00FD85 MDL No:MFCD00143760

Product Description

Catalog Number:
AG00FD85
Chemical Name:
BIS(ACETATO-O)(3-METHOXYPHENYL)IODINE
CAS Number:
69180-50-3
Molecular Formula:
C11H13IO5
Molecular Weight:
352.1224
MDL Number:
MFCD00143760
IUPAC Name:
[acetyloxy-(3-methoxyphenyl)-λ3-iodanyl] acetate
InChI:
InChI=1S/C11H13IO5/c1-8(13)16-12(17-9(2)14)10-5-4-6-11(7-10)15-3/h4-7H,1-3H3
InChI Key:
GLWGBAIOUVBHKQ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)[I](OC(=O)C)OC(=O)C

Properties

Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
351.981g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.124g/mol
Monoisotopic Mass:
351.981g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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