基本情報
- 標準SMILES
CC(=O)N(C)[Si](C)(C)C- InChIKey
QHUOBLDKFGCVCG-UHFFFAOYSA-N- 分子式
- C6H15NOSi
- 平均分子量
- 145.27 g/mol
- 単同位体質量
- 145.09229063
名称と識別子
- 優先名称
- N-Trimethylsilyl-N-methylacetamide
- IUPAC
- N-methyl-N-trimethylsilylacetamide
- 現地名
- N-メチル-N-トリメチルシリルアセトアミド
- 英語名
- N-Methyl-N-(trimethylsilyl)acetamide
- 分子式
- C6H15NOSi
- 分子量
- 145.27
名称と別名
名称をさらに表示
データベース識別子
- CAS
7449-74-3- PubChem CID
- 81953
- DTXSID
DTXSID0064707- UNII
- W0IWF6UKW5
- EC Number
- 231-217-0
- Nikkaji
- J208.694H
物性
構造計算による物性
- 極性表面積
- 20.3 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 1
- 回転可能結合数
- 1
- 重原子数
- 9
- 形式電荷
- 0
- 複雑度
- 117
実験および物理化学的性質
物理化学的性質
- 沸点
- 159 · 159-161 °C(lit.)
- 比重(密度)
- 0.904 g/mL · 0.904 g/mL at 20 °C(lit.)
- 屈折率
- 20 · n20/D 1.439
- 闪点
- 48 °C · 48 °C
- 貯蔵温度
- -20 °C · -20°C
- 外見
- 凍結乾燥粉末
- 酸解離定数(Pka)
- -0.11 · -0.11±0.70(Predicted)
- 色
- クリアライトイエロー
- 比重
- 0.906 · 0.906
- BRN
- 506975 · 506975
- InChI
- InChI=1S/C6H15NOSi/c1-6(8)7(2)9(3,4)5/h1-5H3
- InChIKey
- QHUOBLDKFGCVCG-UHFFFAOYSA-N
- SMILES
- C(N(C)[Si](C)(C)C)(=O)C
- CAS データベース
- 7449 · 7449-74-3(CAS DataBase Reference)
- NISTの化学物質情報
- Acetamide, n-methyl-n-(trimethylsilyl)-(7449-74-3)
- EPAの化学物質情報
- Acetamide, N-methyl-N-(trimethylsilyl)- (7449-74-3)
化学的性質
化学的特性clear light yellow liquid
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 5.9% (1 of 17) of reports.
Danger
H226 (94.1%): Flammable liquid and vapor [Warning Flammable liquids]
P203, P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P317, P318, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 17 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: Acetamide, N-methyl-N-(trimethylsilyl)-
Status: Active Update: 13-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33411
安全データ
- F
- 10-21
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1993 3/PG 3
- hs_code
- 29319090
- risk_code
- 10-36/37/38
- 消防法
- 危-4-2-III
- hazard_code
- Xi
- safety_code
- 37/39-16
- hazard_class
- 3
- packing_group
- III
- Hazard Classifications
- Flam. Liq. 3
- ストレージクラス
- 3 - Flammable liquids
化学と産業
用途と製造
応用分野
使用N-Methyl-N-trimethylsilylacetamide may be used as a derivatizing reagent for the following: Quantification of the carbohydrate intermediates in glycation systems using gas chromatography coupled to mass spectrometry technique. Characterization of damaged products of thymine and cytosine formed by the exposure to UV light in a hydrogen peroxide solution using gas chromatography/mass spectrometry with scan mode and selected ion monitoring mode.
一般的な説明N-Methyl-N-trimethylsilylacetamide is a trialkyl-silyl reagent and a versatile derivatizing agent used in gas chromatography (GC).
調製方法
純化方法N-Methyl-N-trimethylsilylacetamide [7449-74-3] M 145.3, b 48 -49o/11mm, 8 4o/13mm, 105-107o/35mm (solid at room temperature), d 4 0.90, n D 1.4379. A likely impurity is Et3N.HCl which can be detected by its odour. If it is completely soluble in *C6H6, then redistil; otherwise dissolve it in this solvent, filter and evaporate first in a vacuum at 12mm, then fractionate; all operations should be carried out in a dry N2 atmosphere. [Klebe et al. J Am Chem Soc 88 3390 1966, Ried & Suarez-Rivero Chem Ber 96 1473 1963, Beilstein 4 IV 4011.]
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