Home Other Building Blocks 1-(thiophen-2-yl)butan-2-one

1-(thiophen-2-yl)butan-2-one

CAS No.:
56242-36-5
Catalog Number:
AG01AB37
Molecular Formula:
C8H10OS
Molecular Weight:
154.2294
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Product Description
Catalog Number:
AG01AB37
Chemical Name:
1-(thiophen-2-yl)butan-2-one
CAS Number:
56242-36-5
Molecular Formula:
C8H10OS
Molecular Weight:
154.2294
MDL Number:
MFCD12827292
IUPAC Name:
1-thiophen-2-ylbutan-2-one
InChI:
InChI=1S/C8H10OS/c1-2-7(9)6-8-4-3-5-10-8/h3-5H,2,6H2,1H3
InChI Key:
BSWRJPXNNQMGSO-UHFFFAOYSA-N
SMILES:
CCC(=O)Cc1cccs1
Properties
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.045g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.227g/mol
Monoisotopic Mass:
154.045g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties