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1263365-44-1 | 2-(1,3-Dioxolan-2-yl)-1-(2-iodo-phenyl)-ethanone
CAS No: 1263365-44-1 Catalog No: AG01F9H7 MDL No:
Product Description
Catalog Number:
AG01F9H7
Chemical Name:
2-(1,3-Dioxolan-2-yl)-1-(2-iodo-phenyl)-ethanone
CAS Number:
1263365-44-1
Molecular Formula:
C11H11IO3
Molecular Weight:
318.1077
IUPAC Name:
2-(1,3-dioxolan-2-yl)-1-(2-iodophenyl)ethanone
InChI:
InChI=1S/C11H11IO3/c12-9-4-2-1-3-8(9)10(13)7-11-14-5-6-15-11/h1-4,11H,5-7H2
InChI Key:
YRZTZFRRQYQKAO-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1I)CC1OCCO1
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.975g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.11g/mol
Monoisotopic Mass:
317.975g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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