m-Carboxybenzenesulfonic acid
m-Carboxybenzenesulfonic acid structure
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Common Name | m-Carboxybenzenesulfonic acid | ||
|---|---|---|---|---|
| CAS Number | 121-53-9 | Molecular Weight | 202.18500 | |
| Density | 1.62g/cm3 | Boiling Point | N/A | |
| Molecular Formula | C7H6O5S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 3-Phenylsulfonic acid (m-Carboxybenzenesulfonic acid, CAS: 121-53-9), molecular formula C7H6O5S, molecular weight 202.18500, density 1.62g/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 | m-Carboxybenzenesulfonic acid |
|---|---|
| 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 | 1.62g/cm3 |
|---|---|
| Molecular Formula | C7H6O5S |
| Molecular Weight | 202.18500 |
| Exact Mass | 201.99400 |
| PSA | 100.05000 |
| LogP | 1.71230 |
| Index of Refraction | 1.612 |
| InChIKey | QMWGSOMVXSRXQX-UHFFFAOYSA-N |
| SMILES | O=C(O)c1cccc(S(=O)(=O)O)c1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2916399090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 10 | |
|---|---|
| DownStream 10 | |
CAS#:4025-64-3
CAS#:63914-81-8
CAS#:98-88-4
CAS#:65-85-0
CAS#:1227-49-2
CAS#:98-45-3
CAS#:98-07-7
CAS#:7664-93-9
CAS#:632-25-7
CAS#:72021-45-5
CAS#:4052-92-0
CAS#:2136-81-4
CAS#:535-80-8
CAS#:618-46-2
CAS#:618-48-4
CAS#:121-91-5
CAS#:99-06-9
CAS#:1128-76-3This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
|
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Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| m-Sulfobenzoic Acid |
| m-Benzoesaeuresulfonsaeure |
| 3-sulfo-benzoic acid |
| meta-sulfobenzoic acid |
| 3-sulphobenzoic acid |
| EINECS 204-478-3 |
| 3-carboxybenzenesulfonic acid |
| 3-sulfosalicylic acid |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the upstream materials of m-Carboxybenzenesulfonic acid? |
| A: Related upstream materials(CAS) of m-Carboxybenzenesulfonic acid: 4025-64-3;63914-81-8;98-88-4;65-85-0;1227-49-2;98-45-3;98-07-7;7664-93-9;632-25-7;72021-45-5. |
| Q: What is the InChIKey of m-Carboxybenzenesulfonic acid? |
| A: InChIKey of m-Carboxybenzenesulfonic acid is QMWGSOMVXSRXQX-UHFFFAOYSA-N. |
| Q: What are the downstream products of m-Carboxybenzenesulfonic acid? |
| A: Related downstream products(CAS) of m-Carboxybenzenesulfonic acid: 4052-92-0;4025-64-3;2136-81-4;535-80-8;618-46-2;618-48-4;121-91-5;99-06-9;1128-76-3;1227-49-2. |
| Q: What English synonyms does m-Carboxybenzenesulfonic acid have? |
| A: English synonyms of m-Carboxybenzenesulfonic acid: m-Sulfobenzoic Acid, m-Benzoesaeuresulfonsaeure, 3-sulfo-benzoic acid, meta-sulfobenzoic acid, 3-sulphobenzoic acid, EINECS 204-478-3, 3-carboxybenzenesulfonic acid, 3-sulfosalicylic acid. |
| Q: What is the SMILES notation of m-Carboxybenzenesulfonic acid? |
| A: SMILES notation of m-Carboxybenzenesulfonic acid is O=C(O)c1cccc(S(=O)(=O)O)c1. |
| Q: What is the English name of m-Carboxybenzenesulfonic acid? |
| A: The English name of m-Carboxybenzenesulfonic acid is m-Carboxybenzenesulfonic acid. |
| Q: What is the molecular formula of m-Carboxybenzenesulfonic acid? |
| A: Molecular formula of m-Carboxybenzenesulfonic acid is C7H6O5S. |
| Q: What is the CAS number of m-Carboxybenzenesulfonic acid? |
| A: CAS number of m-Carboxybenzenesulfonic acid is 121-53-9. |
| Q: What is the molecular weight of m-Carboxybenzenesulfonic acid? |
| A: Molecular weight of m-Carboxybenzenesulfonic acid is 202.18500. |
| Q: What is the polar surface area (PSA) of m-Carboxybenzenesulfonic acid? |
| A: Polar surface area (PSA) of m-Carboxybenzenesulfonic acid is 100.05000. |