CAS
175277-96-0 Purity
96%
175277-96-0 Purity
96%
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Benzenethiol,2-chloro-4-fluoro-
CAS
175277-99-3
Catalog Number
ACM175277993
Category
Other Products
Molecular Weight
162.61
Molecular Formula
C6H4ClFS
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Specification
Synonyms
ZINC00167095, CID6933710, 175277-99-3
IUPAC Name
2-chloro-4-fluorobenzenethiolate
SMILES
C1=CC(=C(C=C1F)Cl)S
InChI Key
KUAPPJSILOMQPC-UHFFFAOYSA-M
Boiling Point
72ºC
Flash Point
86-88°C/15mm
Density
1.375g/cm³
Exact Mass
161.97100
Hazard Statements
Xi:Irritant/Stench;
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
S26
Downstream Synthesis Route 1
- 175277-99-3
- 286377-24-0
- 286377-45-5
Reference: [1]Bosch, Joan; Roca, Tomàs; Catena, Juan-Lorenzo; Farrerons, Carles; Miquel, Ignasi
[Synthesis, 2000, # 5, p. 721 - 725]
Downstream Synthesis Route 2
- 1722-10-7
- 175277-99-3
- 454182-07-1
Reference: [1]Mylari, Banavara L.; Armento, Sandra J.; Beebe, David A.; Conn, Edward L.; Coutcher, James B.; Dina, Michael S.; O'Gorman, Melissa T.; Linhares, Michael C.; Martin, William H.; Oates, Peter J.; Tess, David A.; Withbroe, Gregory J.; Zembrowski, William J.
[Journal of Medicinal Chemistry, 2003, vol. 46, # 12, p. 2283 - 2286]
[2]Mylari, Banavara L.; Armento, Sandra J.; Beebe, David A.; Conn, Edward L.; Coutcher, James B.; Dina, Michael S.; O'Gorman, Melissa T.; Linhares, Michael C.; Martin, William H.; Oates, Peter J.; Tess, David A.; Withbroe, Gregory J.; Zembrowski, William J.
[Journal of Medicinal Chemistry, 2005, vol. 48, # 20, p. 6326 - 6339]
Downstream Synthesis Route 3
- 175277-99-3
- 643762-62-3
- 643762-63-4
Reference: [1]Liu, Luping; Stelmach, John E.; Natarajan, Swaminathan R.; Chen, Meng-Hsin; Singh, Suresh B.; Schwartz, Cheryl D.; Fitzgerald, Catherine E.; O'Keefe, Stephen J.; Zaller, Dennis M.; Schmatz, Dennis M.; Doherty, James B.
[Bioorganic and Medicinal Chemistry Letters, 2003, vol. 13, # 22, p. 3979 - 3982]
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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