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21906-03-6 | 3-(3-Iodophenyl)butan-2-one
CAS No: 21906-03-6 Catalog No: AG01ECGX MDL No:
Product Description
Catalog Number:
AG01ECGX
Chemical Name:
3-(3-Iodophenyl)butan-2-one
CAS Number:
21906-03-6
IUPAC Name:
3-(3-iodophenyl)butan-2-one
InChI:
InChI=1S/C10H11IO/c1-7(8(2)12)9-4-3-5-10(11)6-9/h3-7H,1-2H3
InChI Key:
BPNFNDJSIQXTOR-UHFFFAOYSA-N
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.985g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.101g/mol
Monoisotopic Mass:
273.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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