4-[[4,6-bis(octylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butylphenol

CAS: 991-84-4

Molecular Formula	`C33H56N4OS2`
Molecular Weight	589.0 g/mol
LogP	13.4
Topological Polar Surface Area	122.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	20
Exact Mass	588.3895
Heavy Atoms	40
Complexity	603.0

Chemical Identifiers

CAS Number	991-84-4
SMILES	`CCCCCCCCSC1=NC(=NC(=N1)NC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)SCCCCCCCC`
InChIKey	`QRLSTWVLSWCGBT-UHFFFAOYSA-N`

📖 Product Overview

4-[[4,6-bis(octylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butylphenol (CAS: 991-84-4) is a chemical compound with molecular formula C33H56N4OS2 and molecular weight 589.0 g/mol. Its IUPAC systematic name is 4-[[4,6-bis(octylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butylphenol. LogP 13.4 Topological Polar Surface Area 122.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 7 Rotatable Bonds 20 Exact Mass 588.3895 Heavy Atoms 40 Complexity 603.0 InChI Key: QRLSTWVLSWCGBT-UHFFFAOYSA-N. SMILES: CCCCCCCCSC1=NC(=NC(=N1)NC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)SCCCCCCCC.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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📚 Academic Support

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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for 4-[[4,6-bis(octylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butylphenol.

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