8005-77-4 Purity
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Specification
The molecular formula of Basic Red 1 is C28H31N2O3.Cl.
The molecular weight of Basic Red 1 is 479.0 g/mol.
Some synonyms for Basic Red 1 are RHODAMINE 6G, 989-38-8, and Rhodamine F5G.
The IUPAC name of Basic Red 1 is [9-(2-ethoxycarbonylphenyl)-6-(ethylamino)-2,7-dimethylxanthen-3-ylidene]-ethylazanium;chloride.
The Canonical SMILES for Basic Red 1 is CCNC1=CC2=C(C=C1C)C(=C3C=C(C(=[NH+]CC)C=C3O2)C)C4=CC=CC=C4C(=O)OCC.[Cl-].
The InChIKey for Basic Red 1 is VYXSBFYARXAAKO-UHFFFAOYSA-N.
The CAS number for Basic Red 1 is 989-38-8.
The UNII for Basic Red 1 is 037VRW83CF.
The hydrogen bond donor count of Basic Red 1 is 2.
The hydrogen bond acceptor count of Basic Red 1 is 5.
Reference: [1]Afonso, Carlos A. M.; Santhakumar; Lough, Alan; Batey, Robert A.
[Synthesis, 2003, # 17, p. 2647 - 2654]
Reference: [1]Afonso, Carlos A. M.; Santhakumar; Lough, Alan; Batey, Robert A.
[Synthesis, 2003, # 17, p. 2647 - 2654]
* For details of the synthesis route, please refer to the original source to ensure accuracy.