基本情報
- 標準SMILES
O=S(=O)(O)CCCN1CCOCC1- InChIKey
DVLFYONBTKHTER-UHFFFAOYSA-N- 分子式
- C7H15NO4S
- 平均分子量
- 209.27 g/mol
- 単同位体質量
- 209.07217913
名称と識別子
- 優先名称
- Mops
- IUPAC
- 3-morpholin-4-ylpropane-1-sulfonic acid
- 現地名
- 3-モルホリノプロパンスルホン酸
- 英語名
- MOPS
- 分子式
- C7H15NO4S
- 分子量
- 209.26
名称と別名
名称をさらに表示
データベース識別子
- CAS
1132-61-2- PubChem CID
- 70807
- DTXSID
DTXSID4044371- ChEMBL
CHEMBL1234443- ChEBI
CHEBI:44115- UNII
- 273BP63NV3
- EC Number
- 214-478-5
- Nikkaji
- J7.270B
物性
構造計算による物性
- XLogP
- -3.1
- 極性表面積
- 75.2 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 5
- 回転可能結合数
- 4
- 重原子数
- 13
- 形式電荷
- 0
- 複雑度
- 227
実験および物理化学的性質
Collision Cross Section
142.7 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID4044371];149.5 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID4044371];154.6 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID4044371];142.4 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID4044371]
物理化学的性質
- 融点
- 277 · 277-282 °C
- 比重(密度)
- 1.3168 · 1.3168 (rough estimate)
- 蒸気圧
- 0 Pa · 0Pa at 25℃
- 屈折率
- 1.637 · 1.6370 (estimate)
- 闪点
- 116 °C · 116 °C
- 貯蔵温度
- room temp
- 溶解性
- 2 O: · H2O: 1M at20℃、透明
- 外見
- 粉体・固形
- 色
- 白い
- PH
- 2.5 · 2.5-4.0 (25℃, 1M in H2O)
- 酸解離定数(Pka)
- 7.2 · 7.2(at 25℃)
- 臭い (Odor)
- 無臭
- 由来生物
- synthetic
- 水溶解度
- 1000 g/L · 1000g/L(20℃)
- Merck
- 14 · 14,6265
- BRN
- 1106776 · 1106776
- 安定性
- 安定。強塩基、強酸化剤とは相容れない。
- 化粧品成分の機能
- バッファリング漂白
- InChI
- 1S/C7H15NO4S/c9-13(10,11)7-1-2-8-3-5-12-6-4-8/h1-7H2,(H,9,10,11)
- InChIKey
- DVLFYONBTKHTER-UHFFFAOYSA-N
- SMILES
- OS(=O)(=O)CCCN1CCOCC1
- LogP
- -2.94 at · -2.94 at 20℃
- CAS データベース
- 1132 · 1132-61-2(CAS DataBase Reference)
- EPAの化学物質情報
- 4 · 4-Morpholinepropanesulfonic acid (1132-61-2)
- Absorption
- 0.05 at · ≤0.05 at 260nm≤0.05 at 280nm
化学的性質
化学的特性White/clear crystalline powder
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 45.9% (189 of 412) of reports.
Warning
H315 (53.4%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (53.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (52.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 412 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 189 of 412 reports by companies.;There are 16 notifications provided by 223 of 412 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
危険有害性情報
Regulatory Information
Chemical: 4-Morpholinepropanesulfonic acid
Status: Active Update: 06-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/21270;Status: Active Update: 09-11-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21115
MOPS: Does not have an individual approval but may be used under an appropriate group standard
法規制情報
Regulatory Information
Chemical: 4-Morpholinepropanesulfonic acid
Status: Active Update: 06-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/21270;Status: Active Update: 09-11-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21115
MOPS: Does not have an individual approval but may be used under an appropriate group standard
安全データ
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- QE9104530
- hs_code
- 29349990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- ストレージクラス
- 11 - Combustible Solids
化学と産業
用途と製造
応用分野
用途MOPS(3-モルホリノプロパンスルホン酸、英:3-(N-morpholino)propanesulfonic acid)は、緩衝剤として利用される有機化合物の一つ。生化学分野で広く用いられる。 20℃においてのpKaは6.15であり、溶液はpH 6.5~7.9および0.02~1 Mの範囲で緩衝液として機能する。 MOPSはポリアクリルアミドゲル電気泳動(PAGE)のバッファーとして推奨されている。 哺乳類細胞株の培養に20 mM以上のMOPSは適していない。
使用Due to its inert nature, 3-morpholinopropanesulfonic acid (MOPS) is widely used as a buffer in many biochemical studies. MOPS has been used as a cell culture additive component in lentiviral particle production, a buffering agent in microbial growth medium and nuclei extraction buffer, a component of Roswell Park Memorial Institute (RPMI) medium for diluting fungal inoculum, and a buffer in capillary-zone electrophoresis to test performance. It is also used for the dilution of proteins from algal samples.
一般的な説明3-(N-Morpholino)propane sulfonic acid (MOPS) is an N-substituted amino sulfonic acid with a morpholinic ring. MOPS is capable of buffering within a pH range of 6.5-7.9. MOPS is widely used in biological and biochemical studies due to its inert properties. It does not interact with any metal ions in solutions and has significant metal-buffer stability especially with copper (Cu), nickel (Ni), manganese (Mn), zinc (Zn), cobalt (Co) ions. MOPS buffer maintains the pH of the mammalian cell culture medium. MOPS functions to maintain pH in denaturing gel electrophoresis of RNA. MOPS can modify lipid interactions and influence the thickness and barrier properties of membranes. MOPS interacts with bovine serum albumin and stabilizes the protein. Hydrogen peroxide oxidizes MOPS slowly to N-oxide form.
上流・下流製品情報
上流原料
サプライヤー50 社
補足説明
定義ChEBI: 3-(N-morpholino)propanesulfonic acid is a Good's buffer substance, pKa = 7.2 at 20 ℃. It is a member of morpholines, a MOPS and an organosulfonic acid. It is a conjugate acid of a 3-(N-morpholino)propanesulfonate. It is a tautomer of a 3-(N-morpholiniumyl)propanesulfonate.
関連反応
関連ノート
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