2580-56-5 Purity
CI 44045
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula of Basic Red 1:1 is C27H29ClN2O3.
Some synonyms for Basic Red 1:1 include 3068-39-1, 3,6-Bis(ethylamino)-9-(2-(methoxycarbonyl)phenyl)-2,7-dimethylxanthylium chloride, and Xanthylium,3,6-bis(ethylamino)-9-[2-(methoxycarbonyl)phenyl]-2,7-dimethyl-,chloride.
The molecular weight of Basic Red 1:1 is 465.0 g/mol.
The IUPAC Name of Basic Red 1:1 is ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)-2,7-dimethylxanthen-3-ylidene]azanium;chloride.
The InChIKey of Basic Red 1:1 is GOVUVIWZMYRXMY-UHFFFAOYSA-N.
The Canonical SMILES of Basic Red 1:1 is CCNC1=CC2=C(C=C1C)C(=C3C=C(C(=[NH+]CC)C=C3O2)C)C4=CC=CC=C4C(=O)OC.[Cl-].
The CAS number of Basic Red 1:1 is 3068-39-1.
The hydrogen bond donor count of Basic Red 1:1 is 2.
The hydrogen bond acceptor count of Basic Red 1:1 is 5.
The topological polar surface area of Basic Red 1:1 is 61.5 Å2.