2-[4-(1,3-ジブチル-1,3,4,6-テトラヒドロ-4,6-ジオキソ-2-チオキソピリミジン-5(2H)-イリデン)-2-ブテニリデン]-3(2H)-ベンゾオキサゾールプロパン-1-スルホン酸ナトリウム

Merocyanine 540

HCID 4072

基本情報

CAS
62796-23-0
標準SMILES
CCCCN1C(=O)C(=CC=CC=C2Oc3ccccc3N2CCCS(=O)(=O)[O-])C(=O)N(CCCC)C1=S.[Na+]
InChIKey
OSQUFVVXNRMSHL-UHFFFAOYSA-M
分子式
C26H32N3NaO6S2
平均分子量
569.7 g/mol
単同位体質量
569.16302238

名称と識別子

優先名称
Merocyanine 540
IUPAC
sodium 3-[2-[4-(1,3-dibutyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)but-2-enylidene]-1,3-benzoxazol-3-yl]propane-1-sulfonate
現地名
2-[4-(1,3-ジブチル-1,3,4,6-テトラヒドロ-4,6-ジオキソ-2-チオキソピリミジン-5(2H)-イリデン)-2-ブテニリデン]-3(2H)-ベンゾオキサゾールプロパン-1-スルホン酸ナトリウム
英語名
MEROCYANINE 540
分子式
C26H33N3O6S2.Na
分子量
570.68

名称と別名

Merocyanine 540DTXSID8069646CHEBI:52129NK-22723(2H)-Benzoxazolepropanesulfonic acid, 2-(4-(1,3-dibutyltetrahydro-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)-2-butenylidene)-, sodium salt3(2H)-Benzoxazolepropanesulfonic acid, 2-[4-(1,3-dibutyltetrahydro-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)-2-butenylidene]-, sodium saltRefChem:156622DTXCID7043534BS0KSN6L1UNSC-36928662796-23-0Merocyanin 540
名称をさらに表示
2-[4-(1,3-ジブチル-1,3,4,6-テトラヒドロ-4,6-ジオキソ-2-チオキソピリミジン-5(2H)-イリデン)-2-ブテニリデン]-3(2H)-ベンゾオキサゾールプロパン-1-スルホン酸ナトリウムメロシアニン5402-[(1E)-3-(1,3-ジブチル-4,6-ジオキソ-2-スルファニリデン-1,3-ジアジナン-5-イリデン)プロパ-1-エン-1-イル]-3-(3-スルホナトプロピル)-1,3-ベンゾオキサゾール-3-イウム2-[(1E)-3-(1,3-ジブチル-2-チオキソ-4,6-ジオキソヘキサヒドロピリミジン-5-イリデン)-1-プロペニル]-3-(3-スルホナトプロピル)ベンゾオキサゾール-3-イウムナトリウム 3-{2-[4-(1,3-ジブチル-4,6-ジオキソ-2-スルファニリデン-1,3-ジアジナン-5-イリデン)ブタ-2-エン-1-イリデン]-2,3-ジヒドロ-1,3-ベンゾオキサゾール-3-イル}プロパン-1-スルホナートmc540Nsc369286MeroCy 540Merocyanine 540,99%Merocyanine 540 (90%)Merocyanine 540 Dye content 90 %MEROCYANINE 540, FOR FLUORESCENCEMerocyanin 540 (Merocyanine 540), Fluorescent membrane indicator
3(2H)-Benzoxazolepropanesulfonicacid,2-[4-(1,3-dibutyltetrahydro-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)-2-buten-1-ylidene]-,sodium salt (1:1)Sodium 3-(2-(4-(1,3-dibutyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)but-2-en-1-ylidene)benzo[d]oxazol-3(2H)-yl)propane-1-sulfonateSCHEMBL179749OSQUFVVXNRMSHL-UHFFFAOYSA-M2417524-85-5F867579F9995-0285sodium 3-((E)-2-((E)-4-(1,3-dibutyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)but-2-en-1-ylidene)benzo[d]oxazol-3(2H)-yl)propane-1-sulfonate

データベース識別子

CAS
62796-23-0
PubChem CID
4072
DTXSID
DTXSID8069646
EC Number
636-309-8

物性

構造計算による物性

極性表面積
151 Ų
水素結合供与体数
0
水素結合受容体数
8
回転可能結合数
12
重原子数
38

物理化学的性質

融点
285 °C · 285 °C (dec.)(lit.)
貯蔵温度
2 · 2-8°C
溶解性
DMSO:可溶
外見
Solid
色
Dark purple to black
BRN
3585252 · 3585252

化学的性質

化学的特性PURPLE CRYSTALLINE SOLID

安全と法規制

GHS分類

GHS Classification · 4 件

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 38 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

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

安全データ

F
3-8-10
wgk
3
tsca
TSCA listed
rtecs
DM4866500
risk_code
36/37/38
hazard_code
Xi

化学と産業

薬理情報

MeSH Pharmacological Classification · 4 件

Agents used in the prophylaxis or therapy of VIRUS DISEASES. Some of the ways they may act include preventing viral replication by inhibiting viral DNA polymerase; binding to specific cell-surface receptors and inhibiting viral penetration or uncoating; inhibiting viral protein synthesis; or blocking late stages of virus assembly.

Chemicals that emit light after excitation by light. The wave length of the emitted light is usually longer than that of the incident light. Fluorochromes are substances that cause fluorescence in other substances, i.e., dyes used to mark or label other compounds with fluorescent tags.

Drugs used to potentiate the effectiveness of radiation therapy in destroying unwanted cells.

Drugs that are pharmacologically inactive but when exposed to ultraviolet radiation or sunlight are converted to their active metabolite to produce a beneficial reaction affecting the diseased tissue. These compounds can be administered topically or systemically and have been used therapeutically to treat psoriasis and various types of neoplasms.

用途と製造

General Manufacturing Information3(2H)-Benzoxazolepropanesulfonic acid, 2-[4-(1,3-dibutyltetrahydro-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)-2-buten-1-ylidene]-, sodium salt (1:1): ACTIVE

応用分野

使用Merocyanine 540 is a fluorescent axonal stain.

サプライヤー41 社

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Henan Rane Chemical Co., Ltd.+86-18738066252 · [email protected]
陕西星贝爱科生物科技有限责任公司029-13572876172 13572876172 · [email protected]

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