Cas no 455-16-3 (4-methylbenzene-1-sulfonyl fluoride)

4-methylbenzene-1-sulfonyl fluoride structure

455-16-3 structure

Product Name:4-methylbenzene-1-sulfonyl fluoride

CAS No:455-16-3

MF:C₇H₇FO₂S

MW:174.192684412003

MDL:MFCD00007421

CID:82317

PubChem ID:9965

Update Time:2025-04-18

4-methylbenzene-1-sulfonyl fluoride Chemical and Physical Properties

Names and Identifiers

- P-toluenesulfonyl fluoride
- 4-Methylbenzenesulfonyl fluoride
- para-toluenesulfonyl fluoride
- p-Toluenesulphonyl fluoride
- Tosyl fluoride
- p-Methylbenzenesulfonyl fluoride
- p-Methylphenylsulfonyl fluoride
- p-Tolylsulfonyl fluoride
- p-toluenesulfonyl fluoride
- 4-methylbenzene-1-sulfonyl fluoride
- J-640211
- p-toluenesulfonylfluoride
- FT-0619533
- Benzenesulfonyl fluoride, 4-methyl-
- J-800213
- NSC 2749
- p-Toluenesulfonyl fluoride, 98%
- NSC2749
- NS00031544
- DTXSID0060014
- InChI=1/C7H7FO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3
- 455-16-3
- EN300-153170
- BRN 2208423
- E78238
- WLN: WSFR D1
- Toluene-4-sulfonyl fluoride
- VS-0060
- Z1255372425
- 4-11-00-00375 (Beilstein Handbook Reference)
- (4-METHYLPHENYL)SULFONYL FLUORIDE
- 4-Tolylsulfonyl fluoride
- alpha-tolylsulfonyl fluoride
- CS-0159325
- AKOS015840472
- EINECS 207-238-6
- SCHEMBL81712
- 4-Methyl-benzenesulfonyl fluoride
- NSC-2749
- phenylmethane sulfonyl fluoride
- IZZYABADQVQHLC-UHFFFAOYSA-
- Toluene-p-sulphonyl fluoride
- 4-Toluenesulfonyl fluoride
- MFCD00007421
- Toluene-4-sulphonyl fluoride
- Tosyl fluoride, 4-Methylbenzenesulphonyl fluoride
- 4-PMSF
- DTXCID4040422
- P-fluorosulfonyltoluene
- MDL： MFCD00007421
- Inchi： 1S/C7H7FO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3
- InChI Key： IZZYABADQVQHLC-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)(=O)(=O)F
- BRN： 2208423

Computed Properties

Exact Mass: 174.01500
Monoisotopic Mass: 174.015078
Isotope Atom Count: 0
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 2
Heavy Atom Count: 11
Rotatable Bond Count: 1
Complexity: 209
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count : 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Surface Charge: 0
Tautomer Count: nothing
XLogP3: nothing
Topological Polar Surface Area: 42.5

Experimental Properties

Color/Form: Not determined
Density: 1.233 g/cm3
Melting Point: 41-42?°C (lit.)
Boiling Point: 112?°C/16?mmHg(lit.)
Flash Point: Degrees Fahrenheit:222.8°F
Degrees Celsius:106°C
Refractive Index: 1.502
Solubility: Very slightly soluble (0.16 g/l) (25 o C),
Water Partition Coefficient: Hydrolyzes in water.
PSA: 42.52000
LogP: 2.73400
Sensitiveness: Moisture Sensitive
Solubility: Not determined

4-methylbenzene-1-sulfonyl fluoride Security Information

Symbol:
Signal Word：Danger
Hazard Statement： H302 + H312 + H332-H314
Warning Statement： P280-P305+P351+P338-P310
Hazardous Material transportation number：UN 3261 8/PG 2
WGK Germany：3
Hazard Category Code： 20/21/22-34
Safety Instruction： S22-S26-S27-S36/37/39-S45
RTECS：XT8050000
Hazardous Material Identification：
HazardClass：8
PackingGroup：II
TSCA：T
Safety Term：8
Packing Group：II
Risk Phrases：R20/21/22; R34
Packing Group：II
Hazard Level：8

4-methylbenzene-1-sulfonyl fluoride Customs Data

HS CODE：2904909090
Customs Data：

China Customs Code:
2904909090

Overview:

2904909090 Sulfonation of other hydrocarbons\nitrification\Nitrosative derivative(Whether halogenated or not). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

Declaration elements:

Product Name, component content, use to

Summary:

HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

4-methylbenzene-1-sulfonyl fluoride Pricemore >>

Related Categories	No.	Product Name	Cas No.	Purity	Specification	Price	update time
XI GE MA AO DE LI QI （ SHANG HAI ） MAO YI Co., Ltd.	117455-10G	4-methylbenzene-1-sulfonyl fluoride	455-16-3		10g	￥525.4	2023-12-10
SHANG HAI XIAN DING Biotechnology Co., Ltd.	TF163-1g	4-methylbenzene-1-sulfonyl fluoride	455-16-3	97%	1g	￥136.0	2022-07-28
SHANG HAI XIAN DING Biotechnology Co., Ltd.	TF163-5g	4-methylbenzene-1-sulfonyl fluoride	455-16-3	97%	5g	￥410.0	2022-07-28
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.	P904798-25g	P-toluenesulfonyl fluoride	455-16-3	96%	25g	936.00	2021-05-17
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.	X93305-25g	p-toluenesulfonylfluoride	455-16-3	96%	25g	￥748.0	2023-09-05
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.	X93305-1g	p-toluenesulfonylfluoride	455-16-3	96%	1g	￥138.0	2023-09-05
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.	X93305-5g	p-toluenesulfonylfluoride	455-16-3	96%	5g	￥228.0	2023-09-05
Fluorochem	002463-1g	4-Toluenesulfonyl fluoride	455-16-3	98%	1g	￡11.00	2022-03-01
Fluorochem	002463-5g	4-Toluenesulfonyl fluoride	455-16-3	98%	5g	￡26.00	2022-03-01
Fluorochem	002463-25g	4-Toluenesulfonyl fluoride	455-16-3	98%	25g	￡74.00	2022-03-01

4-methylbenzene-1-sulfonyl fluoride Production Method

Production Method 1

15223-20-8

455-16-3

811-68-7

Reaction Conditions

1.1 Reagents: Silver fluoride Solvents: Dimethyl sulfoxide ; 12 h, 20 °C

Reference

Silver-mediated radical aryltrifluoromethylthiolation of activated alkenes by S-trifluoromethyl 4-methylbenzenesulfonothioate

Zhao, Xia; et al, Tetrahedron Letters, 2018, 59(18), 1719-1722

Production Method 2

824-79-3

81290-20-2

455-16-3

811-68-7

Reaction Conditions

1.1 Reagents: Aniline , (Diethylamino)sulfur trifluoride
2.1 Reagents: Silver fluoride Solvents: Dimethyl sulfoxide ; 12 h, 20 °C

Reference

Silver-mediated radical aryltrifluoromethylthiolation of activated alkenes by S-trifluoromethyl 4-methylbenzenesulfonothioate

Zhao, Xia; et al, Tetrahedron Letters, 2018, 59(18), 1719-1722

4-methylbenzene-1-sulfonyl fluoride Raw materials

4-methylbenzene-1-sulfonyl fluoride Preparation Products

4-methylbenzene-1-sulfonyl fluoride Suppliers

Amadis Chemical Company Limited

Gold Member

Audited Supplier

(CAS:455-16-3)4-methylbenzene-1-sulfonyl fluoride

Order Number:A1205227

Stock Status:in Stock

Quantity:100g

Purity:99%

Pricing Information Last Updated:Monday, 2 September 2024 15:57

Price ($):469.0

Email:[email protected]

Product Official Link

4-methylbenzene-1-sulfonyl fluoride Related Literature

1. Catalyst-free radical fluorination of sulfonyl hydrazides in water

Lin Tang,Yu Yang,Lixian Wen,Xingkun Yang,Zhiyong Wang Green Chem. 2016 18 1224
2. Facile one-pot synthesis of sulfonyl fluorides from sulfonates or sulfonic acids

Ying Jiang,Njud S. Alharbi,Bing Sun,Hua-Li Qin RSC Adv. 2019 9 13863
3. Accessing secondary amine containing fine chemicals and polymers with an earth-abundant hydroaminoalkylation catalyst

Manfred Man?en,Sabrina S. Scott,Danfeng Deng,Cameron H. M. Zheng,Laurel L. Schafer Green Chem. 2023 25 2629
4. The growing applications of SuFEx click chemistry

A. S. Barrow,C. J. Smedley,Q. Zheng,S. Li,J. Dong,J. E. Moses Chem. Soc. Rev. 2019 48 4731
5. Sulfonylation of aryl boronic acids by sulfonyl fluorides in water under visible-light irradiation

Jingsong Zhen,Yihui Li,Han Yuan,Xiaohong Xu,Xian Du,Xin-Qing Li,Yong Luo Org. Chem. Front. 2023 10 404

Related Categories

Solvents and Organic Chemicals Organic Compounds Benzenoids Benzene and substituted derivatives Toluenes Tosyl compounds

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