2,6-Di-tert-Butyl-4-(dimethylamino)methylphenol

Product Information

Molecular Formula:
C17H29NO
Molecular Weight:
263.42
Description
Antioxidant
Synonyms
DIMETHYL(3,5-DI-TERT-BUTYL-4-HYDROXYBENZYL)AMINE; IONOX(R) 103; 4-DIMETHYLAMINOMETHYL-2,6-DI-TERT-BUTYLPHENOL; 2,6-DI-TERT-BUTYL-(A-DIMETHYLAMINO)-P-CRESOL; 2,6-DI-TERT-BUTYL-4-(DIMETHYLAMINOMETHYL)PHENOL; TIMTEC-BB SBB007983; 2,6-di-tert-butyl-alpha-(dimethyl
IUPAC Name
2,6-ditert-butyl-4-[(dimethylamino)methyl]phenol
Canonical SMILES
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN(C)C
InChI
InChI=1S/C17H29NO/c1-16(2,3)13-9-12(11-18(7)8)10-14(15(13)19)17(4,5)6/h9-10,19H,11H2,1-8H3
InChI Key
VMZVBRIIHDRYGK-UHFFFAOYSA-N
Boiling Point
172ºC (30 torr)
Melting Point
93-94ºC
Flash Point
138 ℃ (C.C)
Purity
N/A
Appearance
powder
Refractive Index
n20/D 1.479 (lit.)

Safety Information

Hazards
H302 H319
Precautionary Statement
P305+P351+P338

Computed Properties

XLogP3
4.7
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
4
Exact Mass
263.224914549 g/mol
Monoisotopic Mass
263.224914549 g/mol
Topological Polar Surface Area
23.5Ų
Heavy Atom Count
19
Formal Charge
0
Complexity
261
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-113912752-A Composite polymerization inhibitor and application thereof, high-stability polyether for polycarboxylate superplasticizer and preparation method thereof 2021-09-29
CN-113671068-A Method for analyzing environmental pollutant targeting exposure component in blood plasma and application thereof 2021-07-27
CN-113493712-A Corrosion inhibitor for oxygen-containing fuel oil and preparation method thereof 2021-07-02
JP-2021080483-A Complex 2021-03-04
CN-112920458-A Slow-release auxiliary agent for high polymer material and preparation method thereof 2021-01-27
CN-112759839-A Composite material for AGM storage battery and application thereof 2021-01-22
KR-102357399-B1 A composition for mixed ion exchange polymers and bad odor removal method 2020-12-22
CN-112592755-A Efficient ashless hydraulic oil complexing agent composition and preparation method thereof 2020-12-14
CN-112029280-A Halogen-free flame-retardant polyamide composite material and preparation method thereof 2020-11-06
CN-112029280-B Halogen-free flame-retardant polyamide composite material and preparation method thereof 2020-11-06

Literatures

PMID Publication Date Title Journal
22506700 2012-01-01 Anaerobic toxicity assay of plasticisers Journal of environmental science and health. Part A, Toxic/hazardous substances & environmental engineering
21353727 2011-05-01 Discovery of novel SERCA inhibitors by virtual screening of a large compound library European journal of medicinal chemistry
21577885 2009-09-12 Dimethyl 2-butyl-2-(3,5-di-tert-butyl-4-hydroxy-benz-yl)malonate Acta crystallographica. Section E, Structure reports online
21577826 2009-09-05 Bis(1,2,2,6,6-penta-methyl-piperidin-4-yl) 2-butyl-2-(3,5-di-tert-butyl-4-hydroxy-benz-yl)malonate (Tinuvin 144) Acta crystallographica. Section E, Structure reports online
16497524 2006-11-01 Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods Journal of molecular graphics & modelling
10989984 2000-07-01 Steroid hormone activity of flavonoids and related compounds Breast cancer research and treatment
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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