2,4-Bis(α,α-diMethylbenzyl)phenol
2,4-Bis(α,α-diMethylbenzyl)phenol structure
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Common Name | 2,4-Bis(α,α-diMethylbenzyl)phenol | ||
|---|---|---|---|---|
| CAS Number | 2772-45-4 | Molecular Weight | 330.463 | |
| Density | 1.063 | Boiling Point | 441.1±14.0 °C at 760 mmHg | |
| Molecular Formula | C24H26O | Melting Point | 63-65 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 204.9±12.0 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Summary: 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL, Chinese name: 2,4-双(α,α-二甲基苯甲基)苯酚, CAS number: 2772-45-4, molecular formula: C24H26O, molecular weight: 330.463. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.063 |
|---|---|
| Boiling Point | 441.1±14.0 °C at 760 mmHg |
| Melting Point | 63-65 °C(lit.) |
| Molecular Formula | C24H26O |
| Molecular Weight | 330.463 |
| Flash Point | 204.9±12.0 °C |
| Exact Mass | 330.198364 |
| PSA | 20.23000 |
| LogP | 6.85 |
| Vapour Pressure | 0.0±1.1 mmHg at 25°C |
| Index of Refraction | 1.579 |
| InChIKey | FMUYQRFTLHAARI-UHFFFAOYSA-N |
| SMILES | CC(C)(c1ccccc1)c1ccc(O)c(C(C)(C)c2ccccc2)c1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H319-H413 |
| Precautionary Statements | P305 + P351 + P338 |
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | 26-27-28.1-36/39 |
| Safety Phrases | S26-S27-S28-S36/39 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| HS Code | 2907199090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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2,4-Bis(α,α-diM... CAS#:2772-45-4 |
| Literature: Ciba-Geigy Corporation Patent: US4347180 A1, 1982 ; Title/Abstract Full Text Show Details Ciba-Geigy Corporation Patent: US4275004 A1, 1981 ; |
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~7%
2,4-Bis(α,α-diM... CAS#:2772-45-4 |
| Literature: Kuninobu, Yoichiro; Matsuki, Takashi; Takai, Kazuhiko Journal of the American Chemical Society, 2009 , vol. 131, # 29 p. 9914 - 9915 |
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~52%
2,4-Bis(α,α-diM... CAS#:2772-45-4
Learn More
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| Literature: Kochnev; Oleynik; Ivanchev; Tolstikov Russian Chemical Bulletin, 2007 , vol. 56, # 6 p. 1125 - 1129 |
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~33%
2,4-Bis(α,α-diM... CAS#:2772-45-4
Detail
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| Literature: Kurashev, M. V.; Struchkov, Yu. T.; Veretyakhina, T. G.; Shklover, V. E. Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), 1986 , vol. 35, # 8 p. 1673 - 1676 Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1986 , # 8 p. 1843 - 1846 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
|---|---|
| DownStream 2 | |
![2-[2-hydroxy-3,5-bis(2-phenylpropan-2-yl)phenyl]sulfonyl-4,6-bis(2-phenylpropan-2-yl)phenol structure](https://image.chemsrc.com/caspic/277/918424-28-9.png)
CAS#:918424-28-9![2-[[2-hydroxy-3,5-bis(2-phenylpropan-2-yl)phenyl]disulfanyl]-4,6-bis(2-phenylpropan-2-yl)phenol structure](https://image.chemsrc.com/caspic/010/921201-48-1.png)
CAS#:921201-48-1This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2907199090 |
|---|---|
| Summary | 2907199090 other monophenols VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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2,4-Bis(alpha,alpha-dimethylbenzyl)phenol
Acta Crystallogr. C 56 (Pt 8) , 1046-7, (2000) The structure of the title compound, 2, 4-bis(1-methyl-1-phenylethyl)phenol, C(24)H(26)O, was found to have a torsion angle of 129.95 (13) degrees for the C-C bond that connects the benzyl carbon to t... |
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Application of a mathematical topological pattern of antihistaminic activity for the selection of new drug candidates and pharmacology assays.
J. Med. Chem. 49(12) , 3667-73, (2006) Molecular topology was used to achieve a mathematical model capable of classifying compounds according to their antihistaminic activity and low sedative effects. By application of this model of activi... |
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A highly efficient catalyst for the “living” and “immortal” polymerization of e-caprolactone and L-lactide. Liu Y-C, et al.
Macromolecules 34(18) , 6196-6201, (2001)
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2,4 DI-CUMYLPHENOL |
| 2,4-Di-α-cumylphenol |
| 2,4-Bis(α,α-dimethylbenzyl)phenol |
| 2,4-Bis(2-phenylpropan-2-yl)phenol |
| 2,4-BIS(ALPHA,ALPHA-DIMETHYLBENZYL)PHENOL |
| EINECS 220-466-0 |
| MFCD00191242 |
| 2,4-Bis(2-phenyl-2-propanyl)phenol |
| 2,4-Bis(1-methyl-1-phenylethyl)phenol |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: Polar surface area (PSA) of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL is 20.23000. |
| Q: What is the English name of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: The English name of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL is 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL. |
| Q: What is the LogP of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: LogP of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL is 6.85. |
| Q: What is the safety information for 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: Safety information for 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL: S26-S27-S28-S36/39. |
| Q: What is the boiling point of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: Boiling point of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL is 441.1±14.0 °C at 760 mmHg. |
| Q: What are the downstream products of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: Related downstream products(CAS) of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL: 918424-28-9;921201-48-1. |
| Q: What is the molecular weight of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: Molecular weight of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL is 330.463. |
| Q: What is the InChIKey of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: InChIKey of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL is FMUYQRFTLHAARI-UHFFFAOYSA-N. |
| Q: What is the melting point of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: Melting point of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL is 63-65 °C(lit.). |
| Q: What is the CAS number of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL? |
| A: CAS number of 2,4-BIS(α,α-DIMETHYLBENZYL)PHENOL is 2772-45-4. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |
| Henan Tianfu Chemical Co., Ltd. |