1-Benzothiophene-3-ol
1-Benzothiophene-3-ol structure
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Common Name | 1-Benzothiophene-3-ol | ||
|---|---|---|---|---|
| CAS Number | 520-72-9 | Molecular Weight | 150.198 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 301.6±15.0 °C at 760 mmHg | |
| Molecular Formula | C8H6OS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 136.2±20.4 °C | |
Summary: 1-Benzothiophene-3-ol (Chinese name: 3-羟基苯并噻吩, CAS number: 520-72-9), molecular formula: C8H6OS, molecular weight: 150.198. 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 | 1-benzothiophen-3-ol |
|---|---|
| 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 | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 301.6±15.0 °C at 760 mmHg |
| Molecular Formula | C8H6OS |
| Molecular Weight | 150.198 |
| Flash Point | 136.2±20.4 °C |
| Exact Mass | 150.013931 |
| PSA | 48.47000 |
| LogP | 3.64 |
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
| Index of Refraction | 1.727 |
| InChIKey | XHQBIYCRFVVHFD-UHFFFAOYSA-N |
| SMILES | Oc1csc2ccccc12 |
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2934999090 |
|---|
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 10 | |
CAS#:3704-28-7![Benzo[b]thiophen-3(2H)-one Structure](https://image.chemsrc.com/caspic/085/130-03-0.png)
CAS#:130-03-0
CAS#:95-15-8
CAS#:7664-93-9
CAS#:141-97-9
CAS#:147-93-3
CAS#:123-54-6
CAS#:135-13-7![3-Aminobenzo[b]thiophene-2-carboxylicacid Structure](https://image.chemsrc.com/caspic/007/40142-71-0.png)
CAS#:40142-71-0![3-hydroxy-benzo[b]thiophene-2-carboxylic acid Structure](https://image.chemsrc.com/caspic/215/191031-07-9.png)
CAS#:191031-07-9
CAS#:10419-32-6![Benzo[f][1]benzothieno[3,2-b]quinoline structure](https://image.chemsrc.com/caspic/383/1491-10-7.png)
CAS#:1491-10-7![Benzo[h][1]benzothieno[3,2-b]quinoline structure](https://image.chemsrc.com/caspic/238/1491-09-4.png)
CAS#:1491-09-4![2-(4-hydroxy-benzylidene)-benzo[b]thiophen-3-one structure](https://image.chemsrc.com/caspic/200/24388-07-6.png)
CAS#:24388-07-6
CAS#:27751-82-2![Benzo[b]thiophene-3(2H)-one 1,1-Dioxide structure](https://image.chemsrc.com/caspic/286/1127-35-1.png)
CAS#:1127-35-1![(2E)-Δ2,2'-Bi[benzo[b]thiophene-3(2H)-one] structure](https://image.chemsrc.com/caspic/180/3844-31-3.png)
CAS#:3844-31-3![7H-benzo[e]benzo[4,5]thieno[3,2-b]indole structure](https://image.chemsrc.com/caspic/390/314-99-8.png)
CAS#:314-99-8This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Agonist activity at human full length Flag-tagged RXR/His-tagged VDR assessed as abil...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3368877
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Name: Antagonist activity at human full length Flag-tagged RXR/His-tagged VDR by Alphascree...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3368878
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| BENZO(b)THIOPHENE-3-OL |
| 3-Hydroxythianaphthene |
| benzo<b>thiophen-3-ol |
| 1-Benzothiophene-3-ol |
| Benzothiophen-3-ol |
| 3-Hydroxybenzothiophene |
| 3-hydroxy-thionaphthene |
| 3-hydroxybenzo[b]thiophene |
| hydroxy benzo[b]thiophene |
| Benzo[b]thiophene-3-ol |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 1-benzothiophen-3-ol? |
| A: LogP of 1-benzothiophen-3-ol is 3.64. |
| Q: What is the InChIKey of 1-benzothiophen-3-ol? |
| A: InChIKey of 1-benzothiophen-3-ol is XHQBIYCRFVVHFD-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 1-benzothiophen-3-ol? |
| A: SMILES notation of 1-benzothiophen-3-ol is Oc1csc2ccccc12. |
| Q: What is the CAS number of 1-benzothiophen-3-ol? |
| A: CAS number of 1-benzothiophen-3-ol is 520-72-9. |
| Q: What is the molecular formula of 1-benzothiophen-3-ol? |
| A: Molecular formula of 1-benzothiophen-3-ol is C8H6OS. |
| Q: What are the downstream products of 1-benzothiophen-3-ol? |
| A: Related downstream products(CAS) of 1-benzothiophen-3-ol: 10419-32-6;1491-10-7;1491-09-4;24388-07-6;27751-82-2;95-15-8;1127-35-1;3844-31-3;314-99-8;130-03-0. |
| Q: What English synonyms does 1-benzothiophen-3-ol have? |
| A: English synonyms of 1-benzothiophen-3-ol: BENZO(b)THIOPHENE-3-OL, 3-Hydroxythianaphthene, benzothiophen-3-ol, 1-Benzothiophene-3-ol, Benzothiophen-3-ol, 3-Hydroxybenzothiophene, 3-hydroxy-thionaphthene, 3-hydroxybenzo[b]thiophene, hydroxy benzo[b]thiophene, Benzo[b]thiophene-3-ol. |
| Q: What is the molecular weight of 1-benzothiophen-3-ol? |
| A: Molecular weight of 1-benzothiophen-3-ol is 150.198. |
| Q: What are the upstream materials of 1-benzothiophen-3-ol? |
| A: Related upstream materials(CAS) of 1-benzothiophen-3-ol: 3704-28-7;130-03-0;95-15-8;7664-93-9;141-97-9;147-93-3;123-54-6;135-13-7;40142-71-0;191031-07-9. |
| Q: What is the polar surface area (PSA) of 1-benzothiophen-3-ol? |
| A: Polar surface area (PSA) of 1-benzothiophen-3-ol is 48.47000. |
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. |