Ethyl 2-(6-(ethylamino)-3-(ethylimino)-2,7-dimethyl-3H-xanthen-9-yl)benzoate hydrochloride (1:1)

HCID 13806

ノート反応

データを補完しています。通常は 1 分以内に完了します

部分構造検索類似構造を探す

基本情報

CAS: 989-38-8
標準SMILES: CCNc1cc2oc3cc(=[NH+]CC)c(C)cc-3c(-c3ccccc3C(=O)OCC)c2cc1C.[Cl-]
InChIKey: VYXSBFYARXAAKO-UHFFFAOYSA-N
分子式: C28H31ClN2O3
平均分子量: 479 g/mol

概要

Rhodamine 6G is an organic chloride salt, a xanthene dye and a rhodamine 6G(1+). It has a role as a fluorochrome.

名称と識別子

優先名称: Ethyl 2-(6-(ethylamino)-3-(ethylimino)-2,7-dimethyl-3H-xanthen-9-yl)benzoate hydrochloride (1:1)
IUPAC: [9-(2-ethoxycarbonylphenyl)-6-(ethylamino)-2,7-dimethylxanthen-3-ylidene]-ethylazanium chloride

名称と別名

DTXSID9010149641232233-19-0Ethyl 2-(6-(ethylamino)-3-(ethylimino)-2,7-dimethyl-3H-xanthen-9-yl)benzoate hydrochloride (1:1)RefChem:1084773DTXCID401473301RHODAMINE 6G989-38-8Basic Red 1C.I. Basic Red 1Rhodamine F5GCalcozine Rhodamine 6GXCI Basic Red 1

名称をさらに表示

Rhodamine 6G chlorideRhodamin 6GBasic Rhodamine Yellow9-(2-(Ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethylxanthylium chlorideRhodanine 6GDNRhodamine 6 G extraAizen Rhodamine 6GCPCI 45160

データベース識別子

CAS: 989-38-8
PubChem CID: 13806
DTXSID: DTXSID1021243
ChEMBL: CHEMBL402140、CHEMBL5305690
ChEBI: CHEBI:52672
UNII: 037VRW83CF

物性

構造計算による物性補完中

極性表面積: 61.5 Å²
水素結合供与体数: 2
水素結合受容体数: 5
回転可能結合数: 7
重原子数: 34
形式電荷: 0
複雑度: 823

化学と産業

用途と製造

UsesSubstance listed with specific concentration in tattoo ink and/or permanent make up according to EU Commission Regulation 2020/2081. The concentration limit (by weight) is 0.1%.