4-Aminodiphenylamine-2-Sulfonic Acid
4-Aminodiphenylamine-2-Sulfonic Acid structure
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Common Name | 4-Aminodiphenylamine-2-Sulfonic Acid | ||
|---|---|---|---|---|
| CAS Number | 91-30-5 | Molecular Weight | 264.300 | |
| Density | 1.5±0.1 g/cm3 | Boiling Point | N/A | |
| Molecular Formula | C12H12N2O3S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 5-amino-2-anilinobenzenesulfonic 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 | 1.5±0.1 g/cm3 |
|---|---|
| Molecular Formula | C12H12N2O3S |
| Molecular Weight | 264.300 |
| Exact Mass | 264.056854 |
| PSA | 100.80000 |
| LogP | 0.19 |
| Index of Refraction | 1.691 |
| InChIKey | HYLOSPCJTPLXSF-UHFFFAOYSA-N |
| SMILES | Nc1ccc(Nc2ccccc2)c(S(=O)(=O)O)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.
| Hazard Codes | T,N |
|---|---|
| Risk Phrases | R22:Harmful if swallowed. R23:Toxic by inhalation. R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment . |
| Safety Phrases | S45-S60-S61 |
| RIDADR | UN2811 6.1/PG 2 |
| HS Code | 2921590090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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4-Aminodiphenyl... CAS#:91-30-5 |
| Literature: Bulletin de la Societe Chimique de France, , p. 526 |
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4-Aminodiphenyl... CAS#:91-30-5 |
| Literature: Chemische Berichte, , vol. 41, p. 3746 DE198137 ; |
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4-Aminodiphenyl... CAS#:91-30-5 |
| Literature: Chemische Berichte, , vol. 41, p. 3746 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
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| DownStream 1 | |
CAS#:101-54-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2921590090 |
|---|---|
| Summary | 2921590090. other aromatic polyamines and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . 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: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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Name: Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
Source: ChEMBL
Target: Klebsiella pneumoniae
External Id: CHEMBL4296186
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Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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Name: Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay
Source: 24386
Target: N/A
External Id: Sarm1 TIR NADase inhibitors
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Nerolsaeure |
| EINECS 202-058-4 |
| 5-Amino-2-anilinebenzenesulphonic acid |
| N-Phenyl-p-phenylenediaminesulfonic acid |
| 5-amino-2-anilino-benzenesulfonic acid |
| Metanilic acid,6-anilino |
| 6-Anilinometanilic acid |
| 4-Aminodiphenylamine-2-Sulfonic Acid |
| 5-amino-2-(phenylamino)benzenesulfonic acid |
| MFCD00035932 |
| 5-Amino-2-anilinobenzenesulfonic acid |
| 4-Amino-2-sulfodiphenylamine |
| 5-Amino-2-anilino-benzolsulfonsaeure |
| 4-Aminodiphenyamine-2-sulfonic acid |
| 4-Amino-diphenylamin-2-sulfonsaeure |
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 5-amino-2-anilinobenzenesulfonic acid? |
| A: Polar surface area (PSA) of 5-amino-2-anilinobenzenesulfonic acid is 100.80000. |
| Q: What is the molecular weight of 5-amino-2-anilinobenzenesulfonic acid? |
| A: Molecular weight of 5-amino-2-anilinobenzenesulfonic acid is 264.300. |
| Q: What is the LogP of 5-amino-2-anilinobenzenesulfonic acid? |
| A: LogP of 5-amino-2-anilinobenzenesulfonic acid is 0.19. |
| Q: What is the SMILES notation of 5-amino-2-anilinobenzenesulfonic acid? |
| A: SMILES notation of 5-amino-2-anilinobenzenesulfonic acid is Nc1ccc(Nc2ccccc2)c(S(=O)(=O)O)c1. |
| Q: What is the molecular formula of 5-amino-2-anilinobenzenesulfonic acid? |
| A: Molecular formula of 5-amino-2-anilinobenzenesulfonic acid is C12H12N2O3S. |
| Q: What is the safety information for 5-amino-2-anilinobenzenesulfonic acid? |
| A: Safety information for 5-amino-2-anilinobenzenesulfonic acid: S45-S60-S61. |
| Q: What are the upstream materials of 5-amino-2-anilinobenzenesulfonic acid? |
| A: Related upstream materials(CAS) of 5-amino-2-anilinobenzenesulfonic acid: 156-10-5;88-35-7. |
| Q: What are the downstream products of 5-amino-2-anilinobenzenesulfonic acid? |
| A: Related downstream products(CAS) of 5-amino-2-anilinobenzenesulfonic acid: 101-54-2. |
| Q: What is the InChIKey of 5-amino-2-anilinobenzenesulfonic acid? |
| A: InChIKey of 5-amino-2-anilinobenzenesulfonic acid is HYLOSPCJTPLXSF-UHFFFAOYSA-N. |
| Q: What is the CAS number of 5-amino-2-anilinobenzenesulfonic acid? |
| A: CAS number of 5-amino-2-anilinobenzenesulfonic acid is 91-30-5. |
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. |