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Molecule
2,2′-Methylenebis[4-Methyl-6-Tert-Butylphenol]
CAS: 119-47-1 · C23H32O2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 119-47-1
- Molecular Formula
- C23H32O2
- Molecular Mass
- 340.51 g/mol
Identifiers
CAS Registry Number
119-47-1
SMILES
Cc1cc(Cc2cc(C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1
InChI Key
KGRVJHAUYBGFFP-UHFFFAOYSA-N
InChI
InChI=1S/C23H32O2/c1-14-9-16(20(24)18(11-14)22(3,4)5)13-17-10-15(2)12-19(21(17)25)23(6,7)8/h9-12,24-25H,13H2,1-8H3
Names and Synonyms
- 2,2′-Methylenebis[4-Methyl-6-Tert-Butylphenol] Systematic Name
- Phenol, 2,2′-methylenebis[6-(1,1-dimethylethyl)-4-methyl- Synonym
- 2,2′-Bis(4-methyl-6-tert-butylphenol)methane Synonym
- Lederle 2246 Synonym
- Bisalkofen BP Synonym
- Bis(2-hydroxy-3-tert-butyl-5-methylphenyl)methane Synonym
- Bis(3-tert-butyl-2-hydroxy-5-methylphenyl)methane Synonym
- Bis(6-hydroxy-3-methyl-5-tert-butylphenyl)methane Synonym
- Calco 2246 Synonym
- 2,2′-Methylenebis[6-tert-butyl-p-cresol] Synonym
- 6,6′-Di-tert-butyl-4,4′-dimethyl-2,2′-methylenediphenol Synonym
- BKF Synonym
- 2,2′-Methylenebis(6-tert-butyl-4-methylphenol) Synonym
- NG 2246 Synonym
- Antioxidant 1 Synonym
- Antioxidant BKF Synonym
- Antioxidant NG 2246 Synonym
- AO 1 (antioxidant) Synonym
- 2,2′-Methylenebis[4-methyl-6-tert-butylphenol] Synonym
- Anti Ox Synonym
- CAO 14 Synonym
- Chemanox 21 Synonym
- Bis(5-methyl-3-tert-butyl-2-hydroxyphenyl)methane Synonym
- Catolin 14 Synonym
- Nocrac NS 6 Synonym
- AO 1 Synonym
- Antage W 400 Synonym
- Sumilizer MDP Synonym
- Cyanox 2246 Synonym
- Vulkanox BKF Synonym
- MBP 5 Synonym
- Agidol 2 Synonym
- Antioxidant OMB Synonym
- Sumilizer MDP-S Synonym
- Santowhite PC Synonym
- Ongrostab 2246 Synonym
- Product 2246 Synonym
- 6,6′-Methylenebis(2-tert-butyl-4-methylphenol) Synonym
- Irganox 2246 Synonym
- Lowinox 22M46 Synonym
- Naftonox 22M46 Synonym
- Yoshinox 2246R Synonym
- Bis(2-hydroxy-5-methyl-3-tert-butylphenyl)methane Synonym
- MDP Synonym
- 3,3′-Di-tert-butyl-2,2′-dihydroxy-5,5′-dimethyldiphenylmethane Synonym
- Plastanox 2246 Synonym
- Yoshinox 2246G Synonym
- GERI-BP 002A Synonym
- Nonflex MPP Synonym
- NS 6 Synonym
- Noclizer NS 6 Synonym
- A 02246 Synonym
- Additin RC 7115 Synonym
- Lowinox 22M48 Synonym
- 2,2′-Methylenebis[4-methyl-6-t-butylphenol] Synonym
- NSC 7781 Synonym
- Sumilizer MDP 9 Synonym
- Nonflex MBP Synonym
- Ionol 46 Synonym
- 2,2′-Methylenebis(4-methyl-6-tert-butylphenol) Synonym
- Vanox MBPC Synonym
- Baynox Plus Synonym
- Antioxidant MBP Synonym
- 6,6-Methylenebis(2-tert-butyl-4-methylphenol) Synonym
- 2,2′-Methylenebis(6-tert-butyl-p-cresol) Synonym
- Akrochem AO 235 Synonym
- AO 235 Synonym
- 2,2- Methylene bis(4-methyl-6-tert-butyl-phenol) Synonym
- 2,2′-Methylidenebis(6-tert-butyl-4-methylphenol) Synonym
- Vulkanox BPH Synonym
- MDP-S Synonym
- 2-tert-Butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenol Synonym
- W 400 Synonym
- p-Cresol, 2,2′-methylenebis[6-tert-butyl- Synonym
- 2,2′-Methylenebis[6-(1,1-dimethylethyl)-4-methylphenol] Synonym
- CAO 5 Synonym
- AO 2246 Synonym
- Advastab 405 Synonym
- Antioxidant 2246 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 340.51 g/mol | CAS Common Chemistry |
| 340.5070000000001 g/mol | RDKit | |
| 340.507 g/mol | RDKit | |
| Canonical SMILES | OC=1C(=CC(=CC1C(C)(C)C)C)CC2=CC(=CC(=C2O)C(C)(C)C)C | CAS Common Chemistry |
| Density | 107-110 g/cm3 | CAS Common Chemistry |
| InChI | InChI=1S/C23H32O2/c1-14-9-16(20(24)18(11-14)22(3,4)5)13-17-10-15(2)12-19(21(17)25)23(6,7)8/h9-12,24-25H,13H2,1-8H3 | CAS Common Chemistry |
| InChI Key | InChIKey=KGRVJHAUYBGFFP-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 118-128 °C | CAS Common Chemistry |
| Name | 2,2′-Methylenebis[4-methyl-6-tert-butylphenol] | CAS Common Chemistry |
| Heavy Atom Count | 25 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 40.46 Ų | RDKit |
| LogP | 5.900440000000007 | RDKit |
| 5.9004 | RDKit | |
| 6.01 | chempirical lib | |
| Molar Refractivity | 105.89360000000006 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.4783 | RDKit |
| 0.48 | chempirical lib | |
| Exact Mass | 340.240230264 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
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200 ppm
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 340.51 g/mol. Edit any field — others recompute live.
