Basic Red 1:1

ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)-2,7-dimethylxanthen-3-ylidene]azanium chloride

CAS: 12238-65-2

Molecular Formula	`C27H29ClN2O3`
Molecular Weight	465.0 g/mol
Topological Polar Surface Area	61.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	464.18668
Heavy Atoms	33
Complexity	807.0

Chemical Identifiers

CAS Number	12238-65-2
SMILES	`CCNC1=CC2=C(C=C1C)C(=C3C=C(C(=[NH+]CC)C=C3O2)C)C4=CC=CC=C4C(=O)OC.[Cl-]`
InChIKey	`GOVUVIWZMYRXMY-UHFFFAOYSA-N`

📖 Product Overview

Basic Red 1:1 (CAS: 12238-65-2) is a chemical compound with molecular formula C27H29ClN2O3 and molecular weight 465.0 g/mol. Its IUPAC systematic name is ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)-2,7-dimethylxanthen-3-ylidene]azanium chloride. Topological Polar Surface Area 61.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 464.18668 Heavy Atoms 33 Complexity 807.0 InChI Key: GOVUVIWZMYRXMY-UHFFFAOYSA-N. SMILES: CCNC1=CC2=C(C=C1C)C(=C3C=C(C(=[NH+]CC)C=C3O2)C)C4=CC=CC=C4C(=O)OC.[Cl-].

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