4-Chlorobenzene-1,2-diamine structure
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Common Name | 4-Chlorobenzene-1,2-diamine | ||
|---|---|---|---|---|
| CAS Number | 95-83-0 | Molecular Weight | 142.586 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 300.2±22.0 °C at 760 mmHg | |
| Molecular Formula | C6H7ClN2 | Melting Point | 70-73 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 135.4±22.3 °C | |
| Symbol |
GHS07, GHS08 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-Chloro-1,2-diaminobenzene |
|---|---|
| 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 | 300.2±22.0 °C at 760 mmHg |
| Melting Point | 70-73 °C(lit.) |
| Molecular Formula | C6H7ClN2 |
| Molecular Weight | 142.586 |
| Flash Point | 135.4±22.3 °C |
| Exact Mass | 142.029770 |
| PSA | 52.04000 |
| LogP | 1.15 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.671 |
| InChIKey | BXIXXXYDDJVHDL-UHFFFAOYSA-N |
| SMILES | Nc1ccc(Cl)cc1N |
| Stability | Stable. Combustible. Incompatible with strong oxidizing agents. |
| Water Solubility | 16 g/L (20 ºC) |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
MUTATION DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07, GHS08 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335-H351 |
| Precautionary Statements | P261-P281-P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges |
| Hazard Codes | Xn:Harmful; |
| Risk Phrases | R36/37/38;R40 |
| Safety Phrases | S26-S36/37 |
| RIDADR | 2811 |
| WGK Germany | 3 |
| RTECS | SS8850000 |
| Packaging Group | I; II; III |
| Hazard Class | 6.1 |
| HS Code | 2921590090 |
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 | |
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| DownStream 10 | |
This 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 lists relevant public references with title, journal and publication metadata for this compound.
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Development of QSAR models for predicting hepatocarcinogenic toxicity of chemicals.
Eur. J. Med. Chem. 44 , 3658-64, (2009) A dataset comprising 55 chemicals with hepatocarcinogenic potency indices was collected from the Carcinogenic Potency Database with the aim of developing QSAR models enabling prediction of the above u... |
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4-Chloro-ortho-phenylenediamine and 4-chloro-meta-phenylenediamine.
IARC Monogr. Eval. Carcinog. Risk Chem. Hum. 27 , 81-9, (1982)
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Carcinogenicity of 4-chloro-o-phenylenediamine, 4-chloro-m-phenylenediamine, and 2-chloro-p-phenylenediamine in Fischer 344 rats and B6C3F1 mice.
Carcinogenesis 1(6) , 495-9, (1980) In both male and female Fischer rats, feeding 4-chloro-o-phenylenediamine at 0.5 or 1% in the diet led to a significant increase in hyperplasia, papilloma and carcinoma of the urinary bladder. Neoplas... |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| EINECS 202-456-8 |
| 4-Chloro-1,2-phenylenediamine |
| 4-Chlorobenzene-1,2-diamine |
| 4-Chloro-1,2-diaminobenzene |
| 4-Chloro-1,2-benzenediamine |
| MFCD00011691 |
| ZR BZ DG |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of 4-Chloro-1,2-diaminobenzene? |
| A: Molecular weight of 4-Chloro-1,2-diaminobenzene is 142.586. |
| Q: How is the water solubility of 4-Chloro-1,2-diaminobenzene? |
| A: Water solubility of 4-Chloro-1,2-diaminobenzene: 16 g/L (20 ºC). |
| Q: What is the InChIKey of 4-Chloro-1,2-diaminobenzene? |
| A: InChIKey of 4-Chloro-1,2-diaminobenzene is BXIXXXYDDJVHDL-UHFFFAOYSA-N. |
| Q: What are the downstream products of 4-Chloro-1,2-diaminobenzene? |
| A: Related downstream products(CAS) of 4-Chloro-1,2-diaminobenzene: 39811-14-8;5448-43-1;3584-66-5;14225-75-3;144729-44-2;14537-47-4;4887-82-5;2818-69-1;51-17-2;94-97-3. |
| Q: What is the English name of 4-Chloro-1,2-diaminobenzene? |
| A: The English name of 4-Chloro-1,2-diaminobenzene is 4-Chloro-1,2-diaminobenzene. |
| Q: What is the polar surface area (PSA) of 4-Chloro-1,2-diaminobenzene? |
| A: Polar surface area (PSA) of 4-Chloro-1,2-diaminobenzene is 52.04000. |
| Q: What is the CAS number of 4-Chloro-1,2-diaminobenzene? |
| A: CAS number of 4-Chloro-1,2-diaminobenzene is 95-83-0. |
| Q: What is the SMILES notation of 4-Chloro-1,2-diaminobenzene? |
| A: SMILES notation of 4-Chloro-1,2-diaminobenzene is Nc1ccc(Cl)cc1N. |
| Q: What is the safety information for 4-Chloro-1,2-diaminobenzene? |
| A: Safety information for 4-Chloro-1,2-diaminobenzene: S26-S36/37. |
| Q: What are the upstream materials of 4-Chloro-1,2-diaminobenzene? |
| A: Related upstream materials(CAS) of 4-Chloro-1,2-diaminobenzene: 89-63-4;1635-61-6;17348-69-5;2207-32-1;610-40-2;7440-66-6;881-51-6;106-47-8;52184-29-9;5228-61-5. |
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. |