Home Halogens 2-Acetyl-3-chlorothiophene

2-Acetyl-3-chlorothiophene

CAS No.:
89581-82-8
Catalog Number:
AG003GAX
Molecular Formula:
C6H5ClOS
Molecular Weight:
160.6213
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Product Description
Catalog Number:
AG003GAX
Chemical Name:
2-Acetyl-3-chlorothiophene
CAS Number:
89581-82-8
Molecular Formula:
C6H5ClOS
Molecular Weight:
160.6213
MDL Number:
MFCD00794248
IUPAC Name:
1-(3-chlorothiophen-2-yl)ethanone
InChI:
InChI=1S/C6H5ClOS/c1-4(8)6-5(7)2-3-9-6/h2-3H,1H3
InChI Key:
GVVITKMOMFXUKN-UHFFFAOYSA-N
SMILES:
CC(=O)c1sccc1Cl
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.975g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.615g/mol
Monoisotopic Mass:
159.975g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties