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1094282-10-6 | 1-[5-(2-iodophenyl)thiophen-2-yl]-2-methylpropan-1-one
CAS No: 1094282-10-6 Catalog No: AG019X1C MDL No:MFCD11207003
Product Description
Catalog Number:
AG019X1C
Chemical Name:
1-[5-(2-iodophenyl)thiophen-2-yl]-2-methylpropan-1-one
CAS Number:
1094282-10-6
Molecular Formula:
C14H13IOS
Molecular Weight:
356.2219
MDL Number:
MFCD11207003
IUPAC Name:
1-[5-(2-iodophenyl)thiophen-2-yl]-2-methylpropan-1-one
InChI:
InChI=1S/C14H13IOS/c1-9(2)14(16)13-8-7-12(17-13)10-5-3-4-6-11(10)15/h3-9H,1-2H3
InChI Key:
HUQKNHBNQRIKGE-UHFFFAOYSA-N
SMILES:
CC(C(=O)c1ccc(s1)c1ccccc1I)C
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.973g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
356.221g/mol
Monoisotopic Mass:
355.973g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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