基本情報
- CAS
57757-57-0- 標準SMILES
O=C(CCSSCCC(=O)ON1C(=O)CCC1=O)ON1C(=O)CCC1=O- InChIKey
FXYPGCIGRDZWNR-UHFFFAOYSA-N- 分子式
- C14H16N2O8S2
- 平均分子量
- 404.4 g/mol
- 単同位体質量
- 404.03480782
概要
used to study interactions of structural proteins; RN given refers to unlabeled cpd
名称と識別子
- 優先名称
- 3,3'-Dithiobis(succinimidyl propionate)
- IUPAC
- (2,5-dioxopyrrolidin-1-yl) 3-[[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropyl]disulfanyl]propanoate
- 現地名
- 3,3'-ジチオジプロピオン酸ジ(N-スクシンイミジル)
- 英語名
- 3,3`-Dithiobispropanoic acid bis(N-hydroxysucciniMde ester)
- 分子式
- C14H16N2O8S2
- 分子量
- 404.42
名称と別名
57757-57-0Disuccinimido dithiobispropionateDTSPLomant's reagentDithiobis(succinimidylpropionate)EVY5D0U6SH3,3'-DITHIO(SUCCINIMIDYL PROPIONATE)NSC-3283863,3'-dithiobis(succinimidyl propionate)2,5-Pyrrolidinedione, 1,1'-(dithiobis((1-oxo-3,1-propanediyl)oxy))bis-DTXSID002064492,5-Pyrrolidinedione, 1,1'-[dithiobis[(1-oxo-3,1-propanediyl)oxy]]bis-
名称をさらに表示
3,3'-ジチオジプロピオン酸ジ(N-スクシンイミジル)3,3'-ジチオジプロピオン酸ビス(2,5-ジオキソピロリジン-1-イル)3,3'-ジチオビス(プロピオン酸2,5-ジオキソ-1-ピロリジニル)3,3'-ジチオビス(プロパン酸2,5-ジオキソピロリジン-1-イル)3,3'-ジチオビス(プロパン酸スクシンイミジル)ジチオビス(スクシンイミジルプロピオナート)3,3'-ジチオビス(プロピオン酸2,5-ジオキソ-1-ピロリジル)3,3'-ジチオビス(プロピオン酸2,5-ジオキソピロリジノ)3,3'-ジチオビス(プロピオン酸2,5-ジオキソピロリジン-1-イル)3,3'-ジチオビスプロピオン酸ジスクシンイミジル3,3'-ジチオジプロピオン酸ビス(2,5-ジオキソ-1-ピロリジニル)3,3'-ジチオビス(プロピオン酸スクシンイミジル)3,3'-ジチオビス(プロパン酸2,5-ジオキソ-1-ピロリジニル)
物性
構造計算による物性
- XLogP
- -1.2
- 極性表面積
- 178 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 10
- 回転可能結合数
- 11
- 重原子数
- 26
- 形式電荷
- 0
- 複雑度
- 552
実験および物理化学的性質
Chemical ClassesOther Classes -> Sulfur Compounds
Physical DescriptionWhite powder; [Sigma-Aldrich MSDS]
物理化学的性質
- 融点
- 128 · 128-133 °C
- 沸点
- 560.1 · 560.1±60.0 °C(Predicted)
- 比重(密度)
- 1.57 · 1.57±0.1 g/cm3(Predicted)
- 貯蔵温度
- -20 °C · -20°C
- 溶解性
- 50 mg/mL · クロロホルム: 50 mg/mL
- 外見
- 粉
- 色
- オフホワイト
- BRN
- 1518074 · 1518074
- InChI
- InChI=1S/C14H16N2O8S2/c17-9-1-2-10(18)15(9)23-13(21)5-7-25-26-8-6-14(22)24-16-11(19)3-4-12(16)20/h1-8H2
- InChIKey
- FXYPGCIGRDZWNR-UHFFFAOYSA-N
- SMILES
- S(CCC(ON1C(=O)CCC1=O)=O)SCCC(ON1C(=O)CCC1=O)=O
- CAS データベース
- 57757 · 57757-57-0(CAS DataBase Reference)
化学的性質
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 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Hazards SummaryA skin and strong eye irritant; May cause CNS depression; [Sigma-Aldrich MSDS] See 2-Hydroxyethyl disulfide. See Disuccinimidyl oxalate.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
安全データ
- F
- 10-21
- wgk
- 3
- hs_code
- 29309090
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- ストレージクラス
- 11 - Combustible Solids
化学と産業
薬理情報
MeSH Pharmacological Classification
Reagents with two reactive groups, usually at opposite ends of the molecule, that are capable of reacting with and thereby forming bridges between side chains of amino acids in proteins; the locations of naturally reactive areas within proteins can thereby be identified; may also be used for other macromolecules, like glycoproteins, nucleic acids, or other.
Substances used for the detection, identification, analysis, etc. of chemical, biological, or pathologic processes or conditions. Indicators are substances that change in physical appearance, e.g., color, at or approaching the endpoint of a chemical titration, e.g., on the passage between acidity and alkalinity. Reagents are substances used for the detection or determination of another substance by chemical or microscopical means, especially analysis. Types of reagents are precipitants, solvents, oxidizers, reducers, fluxes, and colorimetric reagents. (From Grant & Hackh's Chemical Dictionary, 5th ed, p301, p499)
用途と製造
UsesUsed to study interactions of structural proteins. [ChemIDplus]
応用分野
使用3,3`-Dithiobispropanoic acid bis(N-hydroxysucciniMde ester) can be used in the crosslinking of intracellular proteins prior to cell lysis.
一般的な説明3,3′-Dithiodipropionic acid di(N-hydroxysuccinimide ester) (DSP) is a homobifunctional cross-linking reagent containing a cleavable disulfide linkage. It is typically coupled to molecules containing primary amines by amide bonds buffered at pH 7.5 (6.5-8.5).
上流・下流製品情報
上流原料
関連反応
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