キシレンブルーBR

hydrogen (4-((4-(dimethylamino)phenyl)(2-ethoxy-5-sulphonato-4-(sulphonato-p-toluidino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)dimethylammonium, monosodium salt

HCID 164813
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基本情報

CAS
1324-50-1
標準SMILES
CCOc1cc(Nc2ccc(C)cc2S(=O)(=O)[O-])c(S(=O)(=O)[O-])cc1C(=C1C=CC(=[N+](C)C)C=C1)c1ccc(N(C)C)cc1.[Na+]
InChIKey
WQZNLMYQHGWSHK-UHFFFAOYSA-M
分子式
C32H34N3NaO7S2
平均分子量
659.8 g/mol
単同位体質量
659.17358671

名称と識別子

優先名称
hydrogen (4-((4-(dimethylamino)phenyl)(2-ethoxy-5-sulphonato-4-(sulphonato-p-toluidino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)dimethylammonium, monosodium salt
IUPAC
sodium 5-[[4-(dimethylamino)phenyl]-(4-dimethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]-4-ethoxy-2-(4-methyl-2-sulfonatoanilino)benzenesulfonate
現地名
キシレンブルーBR
英語名
ACID VIOLET 6BN
分子式
C32H34N3NaO7S2
分子量
659.75

名称と別名

Hydrogen (4-((4-(dimethylamino)phenyl)(2-ethoxy-5-sulphonato-4-(sulphonato-p-toluidino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)dimethylammonium, monosodium saltMethanaminium, N-(4-((4-(dimethylamino)phenyl)(2-ethoxy-4-((4-methylsulfophenyl)amino)-5-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-methyl-, inner salt, sodium salt (1:1)Hydrogen [4-[[4-(dimethylamino)phenyl][2-ethoxy-5-sulphonato-4-(sulphonato-p-toluidino)phenyl]methylene]cyclohexa-2,5-dien-1-ylidene]dimethylammonium, monosodium saltMethanaminium, N-[4-[[4-(dimethylamino)phenyl][2-ethoxy-4-[(4-methylsulfophenyl)amino]-5-sulfophenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, inner salt, sodium salt (1:1)RefChem:789047215-376-3C.I. Acid Violet 151324-50-1sodium;5-[[4-(dimethylamino)phenyl]-(4-dimethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]-4-ethoxy-2-(4-methyl-2-sulfonatoanilino)benzenesulfonateC.I. Acid Violet 15, monosodium saltMethanaminium,N-[4-[[4-(dimethylamino)phenyl][2-ethoxy-4-[(4-methylsulfophenyl)amino]-5-sulfophenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-,inner salt, sodium salt (1:1)Acid Violet 6BN
名称をさらに表示
C.I.アシッドバイオレット15N-[4-[[4-(ジメチルアミノ)フェニル][2-エトキシ-4-[(4-メチルスルホフェニル)アミノ]-5-スルホナトフェニル]メチレン]-2,5-シクロヘキサジエン-1-イリデン]-N-メチルメタンアミニウムナトウム塩アシッドバイオレット15アシッドバイオレット6BNキシレンブルーBRCI 43525acidviolet6bn,CI43525C.I.Acid Violet 15:C.I.43525ACID VIOLET 6BN, C.I. NO.435255-cyclohexadien-1-ylidene]-n-methyl-)amino]-5-sulfophenyl]methylene]-hydroxmethanaminium,n-[4-[[4-(dimethylamino)phenyl][2-ethoxy-4-[(4-methylsulfophenylsodium 5-[[4-(dimethylamino)phenyl]-(4-dimethyliminiocyclohexa-2,5-dien-1-ylidene)methyl]-4-ethoxy-2-(4-methyl-2-sulfonato-anilino)benzenesulfonate
Acid Violet 6 BNOMerantine Violet 6BGXylene Blue BRKiton Violet 6BNAcid Violet 15Lissamine Violet 6BNAcid Leather Violet 4BMitsui Acid Violet 6BN

データベース識別子

CAS
1324-50-1
PubChem CID
164813
DTXSID
DTXSID20927664
EC Number
215-376-3

物性

構造計算による物性

極性表面積
159 Ų
水素結合供与体数
1
水素結合受容体数
9
回転可能結合数
7
重原子数
45

物理化学的性質

EPAの化学物質情報
15 · C.I. Acid Violet 15 (1324-50-1)

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 39 reports by companies from 2 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

tsca
TSCA listed

化学と産業

用途と製造

General Manufacturing InformationMethanaminium, N-[4-[[4-(dimethylamino)phenyl][2-ethoxy-4-[(4-methylsulfophenyl)amino]-5-sulfophenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, inner salt, sodium salt (1:1): ACTIVE

調製方法

製造方法Bis(4-(dimethylamino)phenyl)methanone and N-p-tolyl-m-phenetidineand phosphorus oxychloride, and then converted to the sodium salt disulfonated.

上流・下流製品情報

サプライヤー1 社

广州市海珠区正鸿商行020-82550624 13016020539 · [email protected]

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