chempirical
Back to Search

Molecule

Pentaerythritol Tetrakis(3,5-Di-Tert-Butyl-4-Hydroxyhydrocinnamate)

CAS: 6683-19-8 · C73H108O12

2D Structure

3D Structure

Loading 3D structure...

Basic Information

CAS Registry Number
6683-19-8
Molecular Formula
C73H108O12
Molecular Mass
1177.65 g/mol

Identifiers

CAS Registry Number

6683-19-8

SMILES

CC(C)(C)c1cc(CCC(=O)OCC(COC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)(COC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)COC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O

InChI Key

BGYHLZZASRKEJE-UHFFFAOYSA-N

InChI

InChI=1S/C73H108O12/c1-65(2,3)49-33-45(34-50(61(49)78)66(4,5)6)25-29-57(74)82-41-73(42-83-58(75)30-26-46-35-51(67(7,8)9)62(79)52(36-46)68(10,11)12,43-84-59(76)31-27-47-37-53(69(13,14)15)63(80)54(38-47)70(16,17)18)44-85-60(77)32-28-48-39-55(71(19,20)21)64(81)56(40-48)72(22,23)24/h33-40,78-81H,25-32,41-44H2,1-24H3

Names and Synonyms

  • Pentaerythritol Tetrakis(3,5-Di-Tert-Butyl-4-Hydroxyhydrocinnamate) Synonym
  • Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, 1,1′-[2,2-bis[[3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-1-oxopropoxy]methyl]-1,3-propanediyl] ester Synonym
  • Tetrakis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionyloxymethyl]methane Synonym
  • Pentaerythritol tetrakis[3-(4-hydroxy-3,5-di-tert-butylphenyl)propionate] Synonym
  • Pentaerythritol 3-(4-hydroxy-3,5-di-tert-butylphenyl)propionate (1:4) Synonym
  • Tetrakis(3,5-di-tert-butyl-4-hydroxyhydrocinnamoyloxymethyl)methane Synonym
  • Tetrakis[3-(4-hydroxy-3,5-di-tert-butylphenyl)propionyloxymethyl]methane Synonym
  • Pentaerythritol tetrakis(4-hydroxy-3,5-di-tert-butyl)hydrocinnamate Synonym
  • Pentaerythrityl tetra-β-(3,5-di-tert-butyl-4-hydroxyphenyl) propionate Synonym
  • Pentaerythritol tetrakis[β-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate] Synonym
  • Pentaerythrityl β-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate Synonym
  • Carbyltetramethylene tetrakis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) Synonym
  • IRG 1010 Synonym
  • Neopentanetetrayl 3,5-di-tert-butyl-4-hydroxyhydrocinnamate Synonym
  • Tetrakis[methylene-3-(3′,5′-di-tert-butyl-4′-hydroxyphenyl)propionato]methane Synonym
  • Tetraalkofen BPE Synonym
  • Tetrakis[[[β-(3,5-di-tert-butyl-4-hydroxyphenyl)propionyl]oxy]methyl]methane Synonym
  • Fenozan 22 Synonym
  • Pentaerythritol tetrakis ester with 3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionic acid Synonym
  • Irganox 1040 Synonym
  • Fenozan 23 Synonym
  • Phenosane 23 Synonym
  • RA 1010 Synonym
  • Pentaerythrityl tetrakis(4-hydroxy-3,5-di-tert-butylphenylpropionate) Synonym
  • Pentaerythritol tetrakis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoate] Synonym
  • Mark AO 60 Synonym
  • Anox 20 Synonym
  • Naugard 10 Synonym
  • Pentaerythrityl tetrakis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate] Synonym
  • Pentaerythrityl tetrakis[3-(3′,5′-di-tert-butyl-4′-hydroxyphenyl)propionate] Synonym
  • Irganox 1010FF Synonym
  • Irganox 1010FP Synonym
  • BP 101 Synonym
  • Sumilizer BP 101 Synonym
  • Pentaerythrityl tetrakis(3,5-di-tert-butyl-4-hydroxy-phenyl)propionate Synonym
  • Ralox 630 Synonym
  • Anox 20AM Synonym
  • AO 1 Synonym
  • ADK Stab AO 60 Synonym
  • AO 60 Synonym
  • Pentaerytrityl tetrakis(3,5-di-tert-butyl-4-hydroxyphenyl)propionate Synonym
  • Tetrakis[methylene-3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionato]methane Synonym
  • Tetrakis[methylene-3-(3′,5′-di-tert-butyl-4′-hydroxyphenyl)propionate]methane Synonym
  • Dovernox 10 Synonym
  • IR 1010 Synonym
  • Tetrakis[methylene-3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate]methane Synonym
  • Hostanox O 10 Synonym
  • Antioxidant 1010 Synonym
  • KY 7910 Synonym
  • Tominox TT Synonym
  • Pentaerythritol tetra[3-(3′,5′-di-tert-butyl-4′-hydroxyphenyl)propanoate] Synonym
  • Tominox TT 50 Synonym
  • AO 1010 Synonym
  • Ultranox 210 Synonym
  • Irganox RA 1010 Synonym
  • Tetrakis(hydroxymethyl)methane tetrakis[β-{3,5-di(tert-butyl)-4-hydroxyphenyl}propionate] Synonym
  • Cyanox 2110 Synonym
  • Arenox A 10 Synonym
  • IX 1010 Synonym
  • Chinox 1010 Synonym
  • A 1010 Synonym
  • A 1010 (antioxidant) Synonym
  • Iruga 1010 Synonym
  • Stabiace PH 1010 Synonym
  • PH 1010 Synonym
  • Irganox 1010 Synonym
  • Irganox 101 Synonym
  • Pentaerythritol tetrakis[β-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoate] Synonym
  • Songnox 1010 Synonym
  • AT 10 Synonym
  • AT 10 (antioxidant) Synonym
  • Evernox 10 Synonym
  • Tetrakis[methylene-3-(3′,5′-di-tert-butyl-4-hydroxyphenyl)propionate]methane Synonym
  • Irganox 1066 Synonym
  • BC 1010 Synonym
  • Quantox 1010 Synonym
  • Longnox 10 Synonym
  • Pentaerythritol tetrakis(3,5-tert-butyl-4-hydroxyhydrocinnamate) Synonym
  • Tinogard TT Synonym
  • Pentaerythritol tetra[β-(3′,5′-di-tert-butyl-4′-hydroxyphenyl)propionate] Synonym
  • TTHP Synonym
  • Irganox L 101 Synonym
  • Antiox 10 Synonym
  • Fero NF 130 Synonym
  • NF 130 Synonym
  • Ethanox 310 Synonym
  • JY 1010 Synonym
  • Richnox 1010 Synonym
  • Chemnox 1010 Synonym
  • S 1010 Synonym
  • KY 1010 Synonym
  • Antioxidant 7910 Synonym
  • Evernox 1010 Synonym
  • X 001 Synonym
  • A 60 Synonym
  • Pentaerythritol tetra [β-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate] Synonym
  • I 1010 Synonym
  • Thanox 1010 Synonym
  • TEX 44 Synonym
  • SK 1010 Synonym
  • ADK-AO 60 Synonym
  • L 101 Synonym
  • Heat Stabilizer 1010 Synonym
  • Tetrakis[methylene(3,5-di-tert-butyl-4-hydroxyhydrocinnamoyloxy)methane Synonym
  • Pentaerythritol tetrakis[3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]]propionate Synonym
  • Tetra[β-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate]pentaerythritol Synonym
  • AT 1010 Synonym
  • Tetrakis[β-(3,5-di-tert-butyl-4-hydroxyphenyl)propionic acid]pentaerythritol ester Synonym
  • Pentaerythritol tetrakis (3-(3′,5′-di-tert-butyl-4-hydroxyphenyl)propionate) Synonym
  • Pentaerythritol tetrakis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) Synonym
  • Jyanox 1010 Synonym
  • Pentaerythritol tetrakis[β-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoate Synonym
  • ADK Stab AO 60P Synonym
  • Rianox 1010 Synonym
  • BASF 1010 Synonym
  • 2,2-Bis(((3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoyl)oxy)methyl)propane-1,3-diyl bis(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propanoate) Synonym
  • [3-[3-(3,5-Ditert-butyl-4-hydroxyphenyl)propanoyloxy]-2,2-bis[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxymethyl]propyl] 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate Synonym
  • AO 18 Synonym
  • AO 60P Synonym
  • Antioxidant B 1010 Synonym
  • S 67391 Synonym
  • Hydrocinnamic acid, 3,5-di-tert-butyl-4-hydroxy-, neopentanetetrayl ester Synonym
  • Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, 2,2-bis[[3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-1-oxopropoxy]methyl]-1,3-propanediyl ester Synonym
  • Hydrocinnamic acid, 3,5-di-tert-butyl-4-hydroxy-, tetraester with pentaerythritol Synonym
  • Pentaerythritol, tetrakis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) Synonym
  • Tetrakis[methylene(3,5-di-tert-butyl-4-hydroxyhydrocinnamate)]methane Synonym
  • Pentaerythritol tetrakis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate] Synonym
  • Pentaerythrityl tetrakis[β-(4-hydroxy-3,5-di-tert-butylphenyl)propionate] Synonym
  • Pentaerythritol 4-hydroxy-3,5-di-tert-butylphenylpropionate Synonym
  • Pentaerythritol tetrakis[β-(4-hydroxy-3,5-di-tert-butylphenyl)propionate] Synonym
  • Pentaerythritol tetrakis[(3,5-di-tert-butyl-4-hydroxyphenyl)propionate] Synonym
  • Sonox 1010 Synonym

All Properties

Comprehensive physical and chemical properties

Property Value Source
Molecular Mass 1177.65 g/mol CAS Common Chemistry
1177.6549999999988 g/mol RDKit
1177.655 g/mol RDKit
Density 0.57 g/cm³ CAS Common Chemistry
0.57 g/cm3 CAS Common Chemistry
Wikipedia Url https://en.wikipedia.org/wiki/Pentaerythritol_tetrakis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) CAS Common Chemistry
Canonical SMILES O=C(OCC(COC(=O)CCC=1C=C(C(O)=C(C1)C(C)(C)C)C(C)(C)C)(COC(=O)CCC=2C=C(C(O)=C(C2)C(C)(C)C)C(C)(C)C)COC(=O)CCC=3C=C(C(O)=C(C3)C(C)(C)C)C(C)(C)C)CCC=4C=C(C(O)=C(C4)C(C)(C)C)C(C)(C)C CAS Common Chemistry
InChI InChI=1S/C73H108O12/c1-65(2,3)49-33-45(34-50(61(49)78)66(4,5)6)25-29-57(74)82-41-73(42-83-58(75)30-26-46-35-51(67(7,8)9)62(79)52(36-46)68(10,11)12,43-84-59(76)31-27-47-37-53(69(13,14)15)63(80)54(38-47)70(16,17)18)44-85-60(77)32-28-48-39-55(71(19,20)21)64(81)56(40-48)72(22,23)24/h33-40,78-81H,25-32,41-44H2,1-24H3 CAS Common Chemistry
InChI Key InChIKey=BGYHLZZASRKEJE-UHFFFAOYSA-N CAS Common Chemistry
Melting Point 119-122 °C CAS Common Chemistry
Name Antioxidant 1010 CAS Common Chemistry
Pentaerythritol tetrakis(3,5-di-tert-butyl-4-hydroxyhydrocinnamate) CAS Common Chemistry
Heavy Atom Count 85 RDKit
Hydrogen Bond Acceptors 12 RDKit
Hydrogen Bond Donors 4 RDKit
Rotatable Bonds 20 RDKit
Aromatic Ring Count 4 RDKit
Topological Polar Surface Area 186.11999999999998 Ų RDKit
186.12 Ų RDKit
LogP 15.879199999999964 RDKit
15.8792 RDKit
Molar Refractivity 341.5802000000006 cm³/mol RDKit
Ring Count 4 RDKit
Formal Charge 0 RDKit
Fraction Csp3 0.6164 RDKit
0.62 chempirical lib
Exact Mass 1176.784078896 g/mol RDKit

Spectral Data

NMR, IR, and Mass spectral data

Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

External Resources

Convert

Quick conversion

MW = 1177.65 g/mol; density = 0.570 g/mL. Edit any field — others recompute live.

Recent Searches

Acetone
Ethanol
↑ ↓ Navigate
esc Close