4-(1-Phenylethyl)resorcin structure
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Common Name | 4-(1-Phenylethyl)resorcin | ||
|---|---|---|---|---|
| CAS Number | 85-27-8 | Molecular Weight | 214.260 | |
| Density | 1.2±0.1 g/cm3 | Boiling Point | 365.1±17.0 °C at 760 mmHg | |
| Molecular Formula | C14H14O2 | Melting Point | 81 °C | |
| MSDS | N/A | Flash Point | 175.2±15.5 °C | |
Use of 4-(1-Phenylethyl)resorcinPhenylethyl resorcinol is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
Summary: 4-(1-phenylethyl)benzene-1,3-diol, also known as 4-(α-methylbenzyl)resorcin, CAS No. 85-27-8, has a molecular formula of C14H14O2 and a molecular weight of 214.260. It appears as a white to light yellow to light orange powder or crystal, with a melting point of 81 °C and a density of 1.2±0.1 g/cm3. 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 | 4-(1-phenylethyl)benzene-1,3-diol |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | Phenylethyl resorcinol is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
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| Related Catalog |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.2±0.1 g/cm3 |
|---|---|
| Boiling Point | 365.1±17.0 °C at 760 mmHg |
| Melting Point | 81 °C |
| Molecular Formula | C14H14O2 |
| Molecular Weight | 214.260 |
| Flash Point | 175.2±15.5 °C |
| Exact Mass | 214.099380 |
| PSA | 40.46000 |
| LogP | 3.10 |
| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
| Index of Refraction | 1.616 |
| InChIKey | PQSXNIMHIHYFEE-UHFFFAOYSA-N |
| SMILES | CC(c1ccccc1)c1ccc(O)cc1O |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2907299090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~65%
4-(1-Phenylethy... CAS#:85-27-8
Learn More
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| Literature: Shukla, Prashant; Choudhary, Manoj K.; Nayak, Sandip K. Synlett, 2011 , # 11 p. 1585 - 1591 |
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~62%
4-(1-Phenylethy... CAS#:85-27-8
Learn More
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| Literature: Shukla, Prashant; Choudhary, Manoj K.; Nayak, Sandip K. Synlett, 2011 , # 11 p. 1585 - 1591 |
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~59%
4-(1-Phenylethy... CAS#:85-27-8
Learn More
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| Literature: Shukla, Prashant; Choudhary, Manoj K.; Nayak, Sandip K. Synlett, 2011 , # 11 p. 1585 - 1591 |
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~%
4-(1-Phenylethy... CAS#:85-27-8 |
| Literature: Deutsche Hydrierwerke Patent: DE689600 , 1934 ; DRP/DRBP Org.Chem. |
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~%
4-(1-Phenylethy... CAS#:85-27-8
Learn More
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| Literature: Shukla, Prashant; Choudhary, Manoj K.; Nayak, Sandip K. Synlett, 2011 , # 11 p. 1585 - 1591 |
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~89%
4-(1-Phenylethy... CAS#:85-27-8
Learn More
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| Literature: Wen, Jingyun; Qi, Haofei; Kong, Xiangjin; Chen, Ligong; Yan, Xilong Synthetic Communications, 2014 , vol. 44, # 13 p. 1893 - 1903 |
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~77%
4-(1-Phenylethy... CAS#:85-27-8
Detail
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| Literature: Kozlikovskii, Ya. B.; Koshchii, V. A.; Butov, S. A. Journal of Organic Chemistry USSR (English Translation), 1986 , vol. 22, p. 543 - 546 Zhurnal Organicheskoi Khimii, 1986 , vol. 22, # 3 p. 606 - 610 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2907299090 |
|---|---|
| Summary | 2907299090 polyphenols; phenol-alcohols。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:5.5%。general tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VER...
Source: ChEMBL
Target: Severe acute respiratory syndrome coronavirus 2
External Id: CHEMBL4513082
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|
Name: Inhibition of human tyrosinase using L-DOPA as substrate incubated for 10 to 20 mins ...
Source: ChEMBL
Target: Tyrosinase
External Id: CHEMBL5331159
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|
Name: SARS-CoV-2 3CL-Pro protease inhibition percentage at 20µM by FRET kind of response f...
Source: ChEMBL
Target: Replicase polyprotein 1ab
External Id: CHEMBL4495582
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-(1-Phenylethyl)-1,3-benzenediol |
| Symwhite 377 |
| QR CQ DY1&R |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of 4-(1-phenylethyl)benzene-1,3-diol? |
| A: CAS number of 4-(1-phenylethyl)benzene-1,3-diol is 85-27-8. |
| Q: What is the InChIKey of 4-(1-phenylethyl)benzene-1,3-diol? |
| A: InChIKey of 4-(1-phenylethyl)benzene-1,3-diol is PQSXNIMHIHYFEE-UHFFFAOYSA-N. |
| Q: What is the boiling point of 4-(1-phenylethyl)benzene-1,3-diol? |
| A: Boiling point of 4-(1-phenylethyl)benzene-1,3-diol is 365.1±17.0 °C at 760 mmHg. |
| Q: What is the SMILES notation of 4-(1-phenylethyl)benzene-1,3-diol? |
| A: SMILES notation of 4-(1-phenylethyl)benzene-1,3-diol is CC(c1ccccc1)c1ccc(O)cc1O. |
| Q: What English synonyms does 4-(1-phenylethyl)benzene-1,3-diol have? |
| A: English synonyms of 4-(1-phenylethyl)benzene-1,3-diol: 4-(1-Phenylethyl)-1,3-benzenediol, Symwhite 377, QR CQ DY1&R. |
| Q: What are the upstream materials of 4-(1-phenylethyl)benzene-1,3-diol? |
| A: Related upstream materials(CAS) of 4-(1-phenylethyl)benzene-1,3-diol: 98-85-1;151-10-0;150-19-6;108-46-3;292638-84-7;1445-91-6. |
| Q: What is the LogP of 4-(1-phenylethyl)benzene-1,3-diol? |
| A: LogP of 4-(1-phenylethyl)benzene-1,3-diol is 3.10. |
| Q: What are the uses of 4-(1-phenylethyl)benzene-1,3-diol? |
| A: Main uses of 4-(1-phenylethyl)benzene-1,3-diol: Phenylethyl resorcinol is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
| Q: What is the English name of 4-(1-phenylethyl)benzene-1,3-diol? |
| A: The English name of 4-(1-phenylethyl)benzene-1,3-diol is 4-(1-phenylethyl)benzene-1,3-diol. |
| Q: What is the molecular weight of 4-(1-phenylethyl)benzene-1,3-diol? |
| A: Molecular weight of 4-(1-phenylethyl)benzene-1,3-diol is 214.260. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Shanghai Top Intermediates Co., Ltd. |
| Henan Tianfu Chemical Co., Ltd. |
| Zhongshan Xingrui Chemical Co. , Ltd. |