4-Amino-2,5-dichlorobenzenesulfonic acid structure
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Common Name | 4-Amino-2,5-dichlorobenzenesulfonic acid | ||
|---|---|---|---|---|
| CAS Number | 88-50-6 | Molecular Weight | 242.080 | |
| Density | 1.7±0.1 g/cm3 | Boiling Point | N/A | |
| Molecular Formula | C6H5Cl2NO3S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 11 °C | |
Summary: 2,5-Dichlorosulfanilic Acid (Chinese name: 2,5-二氯苯胺-4-磺酸,CAS number: 88-50-6), with molecular formula C6H5Cl2NO3S and molecular weight 242.080, is a white to almost white powder or crystal with a density of 1.7±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 | 2,5-Dichlorosulfanilic 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 | 1.7±0.1 g/cm3 |
|---|---|
| Molecular Formula | C6H5Cl2NO3S |
| Molecular Weight | 242.080 |
| Flash Point | 11 °C |
| Exact Mass | 240.936722 |
| PSA | 88.77000 |
| LogP | 1.39 |
| Index of Refraction | 1.648 |
| InChIKey | SJCTXIKOXTUQHC-UHFFFAOYSA-N |
| SMILES | Nc1cc(Cl)c(S(=O)(=O)O)cc1Cl |
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.
| Hazard Codes | Xn;N,N,Xn,T,F |
|---|---|
| Risk Phrases | R22:Harmful if swallowed. R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment . R39/23/24/25:Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed . R23/24 |
| Safety Phrases | S61-S45-S36/37 |
| RIDADR | UN 3082 |
| RTECS | TE6550000 |
| Packaging Group | II |
| Hazard Class | 6.1(a) |
| HS Code | 2921420090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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4-Amino-2,5-dic... CAS#:88-50-6 |
| Literature: Chemische Berichte, , vol. 38, p. 3515 |
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4-Amino-2,5-dic... CAS#:88-50-6 |
| Literature: Journal of the American Chemical Society, , vol. 42, p. 151 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 4 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2921420090 |
|---|---|
| Summary | HS:2921420090 aniline derivatives and their salts 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.
| EINECS 201-836-0 |
| 4-Amino-2,5-dichlorobenzenesulfonic acid |
| MFCD00025159 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What English synonyms does 2,5-Dichlorosulfanilic Acid have? |
| A: English synonyms of 2,5-Dichlorosulfanilic Acid: EINECS 201-836-0, 4-Amino-2,5-dichlorobenzenesulfonic acid, MFCD00025159. |
| Q: What are the downstream products of 2,5-Dichlorosulfanilic Acid? |
| A: Related downstream products(CAS) of 2,5-Dichlorosulfanilic Acid: 27761-65-5;615-93-0;12239-15-5;69121-21-7. |
| Q: What is the SMILES notation of 2,5-Dichlorosulfanilic Acid? |
| A: SMILES notation of 2,5-Dichlorosulfanilic Acid is Nc1cc(Cl)c(S(=O)(=O)O)cc1Cl. |
| Q: What is the safety information for 2,5-Dichlorosulfanilic Acid? |
| A: Safety information for 2,5-Dichlorosulfanilic Acid: S61-S45-S36/37. |
| Q: What is the molecular formula of 2,5-Dichlorosulfanilic Acid? |
| A: Molecular formula of 2,5-Dichlorosulfanilic Acid is C6H5Cl2NO3S. |
| Q: What is the LogP of 2,5-Dichlorosulfanilic Acid? |
| A: LogP of 2,5-Dichlorosulfanilic Acid is 1.39. |
| Q: What is the InChIKey of 2,5-Dichlorosulfanilic Acid? |
| A: InChIKey of 2,5-Dichlorosulfanilic Acid is SJCTXIKOXTUQHC-UHFFFAOYSA-N. |
| Q: What is the polar surface area (PSA) of 2,5-Dichlorosulfanilic Acid? |
| A: Polar surface area (PSA) of 2,5-Dichlorosulfanilic Acid is 88.77000. |
| Q: What is the molecular weight of 2,5-Dichlorosulfanilic Acid? |
| A: Molecular weight of 2,5-Dichlorosulfanilic Acid is 242.080. |
| Q: What are the upstream materials of 2,5-Dichlorosulfanilic Acid? |
| A: Related upstream materials(CAS) of 2,5-Dichlorosulfanilic Acid: 95-82-9;7647-01-0;861784-97-6. |
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. |
| Zhongshan Xingrui Chemical Co. , Ltd. |