Home Other Building Blocks 1-{4-[(2,2-difluoroethyl)sulfanyl]phenyl}ethan-1-one

1-{4-[(2,2-difluoroethyl)sulfanyl]phenyl}ethan-1-one

CAS No.:
1341149-68-5
Catalog Number:
AG019PVB
Molecular Formula:
C10H10F2OS
Molecular Weight:
216.2476
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Product Description
Catalog Number:
AG019PVB
Chemical Name:
1-{4-[(2,2-difluoroethyl)sulfanyl]phenyl}ethan-1-one
CAS Number:
1341149-68-5
Molecular Formula:
C10H10F2OS
Molecular Weight:
216.2476
MDL Number:
MFCD20306164
IUPAC Name:
1-[4-(2,2-difluoroethylsulfanyl)phenyl]ethanone
InChI:
InChI=1S/C10H10F2OS/c1-7(13)8-2-4-9(5-3-8)14-6-10(11)12/h2-5,10H,6H2,1H3
InChI Key:
NJBKKCJYFOBCON-UHFFFAOYSA-N
SMILES:
FC(CSc1ccc(cc1)C(=O)C)F
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.042g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.246g/mol
Monoisotopic Mass:
216.042g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties