Basic information
- CAS
991-84-4- Standard SMILES
CCCCCCCCSc1nc(Nc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)nc(SCCCCCCCC)n1- InChIKey
QRLSTWVLSWCGBT-UHFFFAOYSA-N- Molecular formula
- C33H56N4OS2
- Average molar mass
- 589 g/mol
- Monoisotopic mass
- 588.38955477
Names & identifiers
- Preferred name
- Phenol, 4-((4,6-bis(octylthio)-1,3,5-triazin-2-yl)amino)-2,6-bis(1,1-dimethylethyl)-
- IUPAC
- 4-[[4,6-bis(octylsulfanyl)-1,3,5-triazin-2-yl]amino]-2,6-ditert-butylphenol
- English name
- Antioxidant 565
- Molecular formula
- C33H56N4OS2
- Molecular weight
- 588.95
Names & synonyms
Show more names
Database identifiers
- CAS
991-84-4- PubChem CID
- 70431
- DTXSID
DTXSID1052662- ChEBI
CHEBI:141532- UNII
- O1Q826IX7H
- EC Number
- 213-590-1
- Nikkaji
- J46.602F
Properties
Computed structural properties
- XLogP
- 13.4
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 20
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 603
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 92 · 92-95 °C
- Boiling point
- 670.7 · 670.7±65.0 °C(Predicted)
- Density
- 1.07 · 1.07±0.1 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 12.27 · 12.27±0.70(Predicted)
- color
- White to Off-White
- Cosmetics Ingredients Functions
- ANTIOXIDANT
- InChIKey
- QRLSTWVLSWCGBT-UHFFFAOYSA-N
- SMILES
- C1(O)=C(C(C)(C)C)C=C(NC2=NC(SCCCCCCCC)=NC(SCCCCCCCC)=N2)C=C1C(C)(C)C
- LogP
- 13.2 at · 13.2 at 25℃
- FDA 21 CFR
- 175.105 · 175.105; 175.125; 176.180;177.2600; 178.2010
- Indirect Additives used in Food Contact Substances
- 4 · 4-((4,6-BIS(OCTYLTHIO)6-BIS(OCTYLTHIO)6-BIS(OCTYLTHIO)-S-TRIAZIN-2-YL)AMINO)-2,6-DI-TERT-BUTYLPHENOL
- FDA UNII
- 1 Q826IX7H · O1Q826IX7H
- EPA Substance Registry System
- 4 · Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)- (991-84-4)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P280-P305+P351+P338
- TSCA
- TSCA listed
- HS Code
- 2933.69 · 2933.69.6050
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 11.2% (184 of 1649) of reports.
H413 (88.8%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1649 reports by companies from 4 notifications to the ECHA C&L Inventory.;Reported as not meeting GHS hazard criteria per 184 of 1649 reports by companies.;There are 2 notifications provided by 1465 of 1649 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory Information
Chemical: Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)-
Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 25-07-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/11227
Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)-: Does not have an individual approval but may be used under an appropriate group standard
Regulatory information
Regulatory Information
Chemical: Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)-
Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 25-07-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/11227
Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)-: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- tsca
- TSCA listed
- hs_code
- 2933.69.6050
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H332-H335
- REACH Registrations
- Active
- Precautionary statements
- P261-P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
Adhesive Manufacturing;Plastics Material and Resin Manufacturing;Plastics Product Manufacturing
Phenol, 4-[[4,6-bis(octylthio)-1,3,5-triazin-2-yl]amino]-2,6-bis(1,1-dimethylethyl)-: ACTIVE
Applications
DescriptionAntioxidants are a class of chemicals that, when present only in small quantities in a polymer system, can slow or inhibit the oxidation of the polymer, thereby preventing the polymer from aging and extending its service life. They are also called "antiaging agents". Antioxidant 565, chemical name of which is 6-(4-hydroxy-3, 5-ditert-butyl phenyl amino)-2, 4-din-n-octyl sulfide -1, 3, 5-triazine, is white crystalline powder, soluble in many organic solvents, insoluble in water.
Upstream & downstream products
Upstream raw materials
Suppliers100 total
Additional notes
DefinitionChEBI: 4-((4,6-bis(octylthio)-1,3,5-triazin-2-yl)amino)-2,6-di-tert-butylphenol is a member of triazines.
Related reactions
Compound notes
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