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1665-41-4 | Ethanone, 1-(5-phenyl-2-thienyl)-
CAS No: 1665-41-4 Catalog No: AG001WS1 MDL No:MFCD00159557
Product Description
Catalog Number:
AG001WS1
Chemical Name:
Ethanone, 1-(5-phenyl-2-thienyl)-
CAS Number:
1665-41-4
Molecular Formula:
C12H10OS
Molecular Weight:
202.2722
MDL Number:
MFCD00159557
IUPAC Name:
1-(5-phenylthiophen-2-yl)ethanone
InChI:
InChI=1S/C12H10OS/c1-9(13)11-7-8-12(14-11)10-5-3-2-4-6-10/h2-8H,1H3
InChI Key:
SPXBZAHGTSZQLL-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(s1)c1ccccc1
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.045g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.271g/mol
Monoisotopic Mass:
202.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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