Home Other Building Blocks 3-(Thiophen-2-yl)-1-(p-tolyl)prop-2-en-1-one

3-(Thiophen-2-yl)-1-(p-tolyl)prop-2-en-1-one

CAS No.:
6028-89-3
Catalog Number:
AG003I1K
Molecular Formula:
C14H12OS
Molecular Weight:
228.3095
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Product Description
Catalog Number:
AG003I1K
Chemical Name:
3-(Thiophen-2-yl)-1-(p-tolyl)prop-2-en-1-one
CAS Number:
6028-89-3
Molecular Formula:
C14H12OS
Molecular Weight:
228.3095
MDL Number:
MFCD00022532
IUPAC Name:
(E)-1-(4-methylphenyl)-3-thiophen-2-ylprop-2-en-1-one
InChI:
InChI=1S/C14H12OS/c1-11-4-6-12(7-5-11)14(15)9-8-13-3-2-10-16-13/h2-10H,1H3/b9-8+
InChI Key:
OUDDTWPBSXBJOY-CMDGGOBGSA-N
SMILES:
Cc1ccc(cc1)C(=O)/C=C/c1cccs1
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
228.061g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.309g/mol
Monoisotopic Mass:
228.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties