N-Ethyl-p-toluenesulfonamide
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基本情報
- CAS
1321-54-6- 標準SMILES
CCNS(=O)(=O)c1ccc(C)cc1- InChIKey
OHPZPBNDOVQJMH-UHFFFAOYSA-N- 分子式
- C9H13NO2S
- 平均分子量
- 199.27 g/mol
- 単同位体質量
- 199.06669966
概要
Platelets (from dilute alcohol or ligroin) or off-white solid. (NTP, 1992)
名称と識別子
- 優先名称
- N-Ethyl-p-toluenesulfonamide
- IUPAC
- N-ethyl-4-methylbenzenesulfonamide
- 英語名
- Ethyl-p-toluenesulfonamide
- 分子式
- C9H13NO2S
- 分子量
- 199.273
名称と別名
N-ETHYL-P-TOLUENESULFONAMIDEN-Ethyl-4-methylbenzenesulfonamideN-Ethyl-p-tolylsulfonamideBenzenesulfonamide, N-ethyl-4-methyl-N-Ethyl-4-toluenesulfonamideEthyl tosylamidep-Tolueneethylsulfonamideethyl-p-toluenesulfonamideN-Ethyltoluene-4-sulphonamideNSC 68803DTXSID5025310CCRIS 6037
名称をさらに表示
N-Ethylp-toluene Sulfonamide(N-PTSA)Ethyl-p-toluenesulfonamide ISO 9001：2015 REACH
N-Ethyl-4-methyl benzenesulfonamideEINECS 201-275-1992S798SJBNSC-68803DTXCID4053104-Toluenesulfonamide, N-ethyl-ETHYL P-TOLUENESULFONAMIDEOHPZPBNDOVQJMH-UHFFFAOYSA-
データベース識別子
- CAS
1321-54-6、80-39-7- PubChem CID
- 6637
- DTXSID
DTXSID5025310- ChEMBL
CHEMBL1492809- UNII
- 992S798SJB
- EC Number
- 201-275-1
- Nikkaji
- J45.867H
物性
構造計算による物性補完中
- XLogP
- 1.6
- 極性表面積
- 54.6 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 3
- 回転可能結合数
- 3
- 重原子数
- 13
- 形式電荷
- 0
- 複雑度
- 235
実験および物理化学的性質
Chemical ClassesNitrogen Compounds -> Sulfonamides
CosmeticsPlasticiser; Film forming
Solubilityless than 1 mg/mL at 70 °F (NTP, 1992)
Melting Point147 °F (NTP, 1992)
Food Contact Substances
FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications
Physical Description
Platelets (from dilute alcohol or ligroin) or off-white solid. (NTP, 1992)
Liquid
Solid; [CAMEO]
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 22.6% (19 of 84) of reports.
Warning
H315 (72.6%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 84 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
Chemical: Benzenesulfonamide, N-ethyl-4-methyl-
Benzenesulfonamide, N-ethyl-4-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenesulfonamide, N-ethyl-4-methyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Benzenesulfonamide, N-ethyl-4-methyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Fire HazardsFlash point data for this chemical are not available; however, it is probably combustible. (NTP, 1992)
Hazards SummaryA skin and strong eye irritant; [Sigma-Aldrich MSDS] See Toluenesulfonamide.
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile
An amide. Organic amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx).
化学と産業
用途と製造
UsesPermitted for use as an inert ingredient in non-food pesticide products; [EPA]
U.S. Production2023: 183,987 lb
Industry UsesPlasticizer
Household ProductsInformation on 4 consumer products that contain Ethyl tosylamide in the following categories is provided:
Use ClassificationCosmetics -> Plasticiser; Film forming
General Manufacturing Information
Printing Ink Manufacturing
Benzenesulfonamide, N-ethyl-4-methyl-: ACTIVE
関連反応
13 件
化合物ノート
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