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Home Other Building Blocks 4-Fluorobenzyl mercaptan

4-Fluorobenzyl mercaptan

CAS No.:
15894-04-9
Catalog Number:
AG001R1H
Molecular Formula:
C7H7FS
Molecular Weight:
142.1939
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>95.0%(GC)(T)
1 week
United States
$171
- +
Product Description
Catalog Number:
AG001R1H
Chemical Name:
4-Fluorobenzyl mercaptan
CAS Number:
15894-04-9
Molecular Formula:
C7H7FS
Molecular Weight:
142.1939
MDL Number:
MFCD00040724
IUPAC Name:
(4-fluorophenyl)methanethiol
InChI:
InChI=1S/C7H7FS/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2
InChI Key:
RKTRHMNWVZRZJQ-UHFFFAOYSA-N
SMILES:
SCc1ccc(cc1)F
EC Number:
240-031-9
Properties
Complexity:
77  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
142.191g/mol
Monoisotopic Mass:
142.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
An alkyl spacer effect on the structure of 4-fluorobenzenethiol and 4-fluorobenzenemethanethiol self-assembled monolayers on Au(111). Journal of nanoscience and nanotechnology 20120501
S-benzylisothiourea derivatives as small-molecule inhibitors of indoleamine-2,3-dioxygenase. Bioorganic & medicinal chemistry letters 20100901
Properties