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
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
172°C (30 torr)
Melting Point
93-94°C
Flash Point
138 °C (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 |
