玫红 (CAS 50292-91-6)

1(3H)-Isobenzofuranone, 3,3-bis(1-butyl-2-methyl-1H-indol-3-yl)-

CAS 50292-91-6  ·  C34H36N2O2  ·  MW 504.7 g/mol

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3D model 1(3H)-Isobenzofuranone, 3,3-bis(1-butyl-2-methyl-1H-indol-3-yl)-, CAS 50292-91-6, molecular formula C34H36N2O2, molar mass 504.7 g/mol
About 玫红 (CAS 50292-91-6)

玫红 (CAS 50292-91-6) is a chemical compound registered under number CAS 50292-91-6, with the molecular formula C34H36N2O2, and a molar mass of 504.7 g/mol.

The molecule contains 74 atoms connected by 79 chemical bonds. The full systematic IUPAC name of this compound is 3,3-bis(1-butyl-2-methylindol-3-yl)-2-benzofuran-1-one. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 7.9 (positive value, a lipophilic compound), polar surface area PSA = 36.2 Ų, 0 donors and 2 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Wzór sumarycznyC34H36N2O2
Masa molowa504.7 g/mol
IUPAC3,3-bis(1-butyl-2-methylindol-3-yl)-2-benzofuran-1-one
SMILESCCCCN1C(=C(C2=CC=CC=C21)C3(C4=CC=CC=C4C(=O)O3)C5=C(N(C6=CC=CC=C65)CCCC)C)C
InChIKeyJZEPXWWZAJGALH-UHFFFAOYSA-N
logP (XLogP3)7.9
PSA36.2 Ų
HBD / HBA0 / 2
PubChem CIDCID 162583 ↗
Scientific literature

Brak artykułów naukowych dla CAS 50292-91-6 w PubMed / OpenAlex / Semantic Scholar.

Synonyms
50292-91-6 · 1(3H)-Isobenzofuranone, 3,3-bis(1-butyl-2-methyl-1H-indol-3-yl)- · EINECS 256-523-1 · 3,3-Bis(1-butyl-2-methyl-1H-indol-3-yl)phthalide · 3,3-bis(1-butyl-2-methylindol-3-yl)phthalide · RefChem:408828 · DTXCID8040808 · 256-523-1 · 3,3-Bis(1-butyl-2-methyl-1H-indol-3-yl)isobenzofuran-1(3H)-one · C34H36N2O2 · 3,3-bis(1-butyl-2-methylindol-3-yl)-2-benzofuran-1-one · MFCD23135512 · 3,3-bis(1-butyl-2-methyl-1H-indol-3-yl)-1,3-dihydro-2-benzofuran-1-one · Copikem Magenta · Copikem 20
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