基本情報
- CAS
2288-13-3- 標準SMILES
C[Si]12OCCN(CCO1)CCO2- InChIKey
DZLQWMNVOBAZGC-UHFFFAOYSA-N- 分子式
- C7H15NO3Si
- 平均分子量
- 189.28 g/mol
- 単同位体質量
- 189.08211987
概要
Methylsilatrane appears as white crystals or granular solid with a slight odor. (NTP, 1992)
名称と識別子
- 優先名称
- Methylsilatrane
- IUPAC
- 1-methyl-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
- 現地名
- 1-メチル-2,8,9-トリオキサ-5-アザ-1-シラビシクロ[3.3.3]ウンデカン
- 英語名
- METHYLSILATRANE
- 分子式
- C7H15NO3Si
- 分子量
- 189.28
名称と別名
Methylsilatrane1-Methylsilatrane1-methyl-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecaneMethylsilatranMethylsilatran [German]UNII-98BUR3AW0M2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-methyl-EINECS 218-928-198BUR3AW0M2,8,9-TRIOXA-5-AZA-1-SILABICYCLO(3.3.3)UNDECANE, 1-METHYL-DTXSID40256601-Methyl-2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane
名称をさらに表示
1-メチル-1-シラ-2,8,9-トリオキサ-5-アザビシクロ[3.3.3]ウンデカン1-メチル-1-シラ-5-アザ-2,8,9-トリオキサビシクロ[3.3.3]ウンデカン1-メチルシラトラン1-メチル-2,8,9-トリオキサ-5-アザ-1-シラビシクロ[3.3.3]ウンデカンメチルシラトランDK011CAS2288-13-3 METHYLSILATRANE9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane,1-methyl-89-trioxa-5-aza-1-silabicyclo(3.3.3)undecane,1-methyl-81-Methyl-1-sila-2,8,9-trioxa-5-azabicyclo[3.3.3]undecane
1-Methyl-2,8,9-trioxo-5-aza-1-silabicyclo(3.3.3)undecaneRefChem:158315DTXCID505660DZLQWMNVOBAZGC-UHFFFAOYSA-N2288-13-35-methyl-4,6,11-trioxa-1-aza-5-silabicyclo[3.3.3]undecaneMFCD00051471SCHEMBL358346
物性
構造計算による物性
- 極性表面積
- 30.9 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 4
- 回転可能結合数
- 0
- 重原子数
- 12
- 形式電荷
- 0
- 複雑度
- 140
実験および物理化学的性質
SpringerMaterials PropertiesSchoenflies notation
Solubilityless than 1 mg/mL at 68.9 °F (NTP, 1992)
Flash Pointgreater than 305.6 °F (NTP, 1992)
Boiling Point345 °F at 31 mmHg (NTP, 1992)
Melting Point306 °F (NTP, 1992)
Vapor Densitygreater than 1 (NTP, 1992) (Relative to Air)
Physical DescriptionMethylsilatrane appears as white crystals or granular solid with a slight odor. (NTP, 1992)
物理化学的性質
- 融点
- 152 °C · 152 °C
- 沸点
- 174 °C · 174 °C
- 比重(密度)
- 1.12 · 1.12±0.1 g/cm3(Predicted)
- 闪点
- 110 · 110
- 外見
- 個体
- 酸解離定数(Pka)
- 9.23 · 9.23±0.20(Predicted)
- EPAの化学物質情報
- 2 · 2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-methyl- (2288-13-3)
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
Warning
H315 (100%): 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 13 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Fire HazardsThis chemical is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: This chemical may cause irritation of the eyes and skin.
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity ProfileMETHYLSILATRANE is incompatible with strong oxidizing materials. (NTP, 1992)
Air and Water ReactionsInsoluble in water.
安全と保護具
Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
化学と産業
用途と製造
General Manufacturing Information2,8,9-Trioxa-5-aza-1-silabicyclo[3.3.3]undecane, 1-methyl-: ACTIVE
応用分野
一般的な説明White crystals or granular solid with a slight odor.
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