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658-28-6 | (3-Fluorophenyl);(methyl);sulfane
CAS No: 658-28-6 Catalog No: AG003JHV MDL No:MFCD03789131
Product Description
Catalog Number:
AG003JHV
Chemical Name:
(3-Fluorophenyl);(methyl);sulfane
CAS Number:
658-28-6
Molecular Formula:
C7H7FS
Molecular Weight:
142.1939
MDL Number:
MFCD03789131
IUPAC Name:
1-fluoro-3-methylsulfanylbenzene
InChI:
InChI=1S/C7H7FS/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3
InChI Key:
SQXSNYMCORGWCE-UHFFFAOYSA-N
SMILES:
CSc1cccc(c1)F
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.191g/mol
Monoisotopic Mass:
142.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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