4-Chlorophenyl trifluoromethanesulfonate

CAS

29540-84-9

Catalog Number

ACM29540849

Category

Other Products

Molecular Weight

260.62

Molecular Formula

C₇H₄ClF₃O₃S

MSDS COA Spec Sheet

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Specification

Synonyms

4-CHLOROPHENYL TRIFLUOROMETHANESULFONATE;4-CHLOROPHENYL TRIFLUOROMETHANESULPHONATE;4-Chlorophenyl trifluoromethanesulphonate 97%;4-Chlorophenyltrifluoromethanesulphonate97%

IUPAC Name

(4-chlorophenyl) trifluoromethanesulfonate

Canonical SMILES

C1=CC(=CC=C1OS(=O)(=O)C(F)(F)F)Cl

InChI Key

NIIJLHLBNABUFL-UHFFFAOYSA-N

Boiling Point

270.6ºC at 760mmHg

Flash Point

117.4ºC

Density

1.6g/cm³

Exact Mass

259.95200

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

H-Bond Donor

Safety Description

26-36/37/39

Upstream Synthesis Route 1

358-23-6
106-48-9

29540-84-9

Reference: [1]Jutand, Anny; Negri, Serge; Mosleh, Adil
[Journal of the Chemical Society. Chemical communications, 1992, # 23, p. 1729 - 1730]
[2]Jutand, Anny; Mosleh, Adil
[Journal of Organic Chemistry, 1997, vol. 62, # 2, p. 261 - 274]

Downstream Synthesis Route 1

29540-84-9
98-80-6

17763-78-9

Reference: [1] Journal of the American Chemical Society, 2000, vol. 122, # 17, p. 4020 - 4028

Downstream Synthesis Route 2

29540-84-9
960-16-7

17763-78-9

Reference: [1] Journal of the American Chemical Society, 2002, vol. 124, # 22, p. 6343 - 6348

Downstream Synthesis Route 3

29540-84-9
934-56-5

17763-78-9
2051-62-9

Reference: [1] Angewandte Chemie - International Edition, 2011, vol. 50, # 35, p. 8192 - 8195

Downstream Synthesis Route 4

124-38-9
29540-84-9

74-11-3

Reference: [1]Bhunia, Samir Kumar; Das, Pritha; Nandi, Shantanu; Jana, Ranjan
[Organic Letters, 2019, vol. 21, # 12, p. 4632 - 4637]
[2]Jutand, Anny; Negri, Serge; Mosleh, Adil
[Journal of the Chemical Society. Chemical communications, 1992, # 23, p. 1729 - 1730]
[3]Jutand, Anny; Négri, Serge
[European Journal of Organic Chemistry, 1998, # 9, p. 1811 - 1821]
[4]Shimomaki, Katsuya; Nakajima, Tomoya; Caner, Joaquim; Toriumi, Naoyuki; Iwasawa, Nobuharu
[Organic Letters, 2019, vol. 21, # 12, p. 4486 - 4489]

Downstream Synthesis Route 5

29540-84-9
98-80-6

2051-62-9

Reference: [1]Ishikawa, Shunpei; Manabe, Kei
[Tetrahedron, 2010, vol. 66, # 1, p. 297 - 303]

* For details of the synthesis route, please refer to the original source to ensure accuracy.