Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
바이올렛 NO.1
바이올렛NO.1 · 바이올렛NO.1(VIOLETNO.1) · [4-[[4-(다이메틸아미노)페닐][4-[에틸(3-설포네이토벤질)아미노]페닐]메틸렌]사이클로헥사-2,5-다이엔-1-일리덴](에틸)(3-설포네이토벤질)암모늄 · 벤질바이올렛([4-[[4-(다이메틸아미노)페닐][4-[에틸(3-설포네이토벤질)아미노]페닐]메틸렌]사이클로헥사-2,5-다이엔-1-일리덴](에틸)(3-설포네이토벤질)암모늄염및소듐염 · 벤질바이올렛([4-[[4-(다이메틸아미노)페닐][4-[에틸(3-설포네이토벤질)아미노]페닐]메틸렌]사이클로헥사-2,5-다이엔-1-일리덴](에틸)(3-설포네이토벤질)암모늄염 · 애시드바이올렛49 · violet2 · violet5b
식별자 및 물리적 특성
| CAS No. | 1694-09-3 |
|---|---|
| 분자식 | C39H40N3NaO6S2 |
| 평균 분자량 | 733.9 g/mol |
| 단동위원소 질량 | 733.22562263 g/mol |
| SMILES | CCN(Cc1cccc(S(=O)(=O)[O-])c1)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccc(N(CC)Cc3cccc(S(=O)(=O)[O-])c3)cc2)cc1.[Na+] |
| InChIKey | AXMCIYLNKNGNOT-UHFFFAOYSA-M |
| PubChem CID | 5284479 |
| DTXSID | DTXSID7021441 |
| 현지명 | 바이올렛 NO.1 |
화학 및 물리적 성질
| 극성 표면적 | 141 |
|---|---|
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 8 |
| 회전 가능 결합 수 | 10 |
| 무거운 원자 수 | 51 |
| 형식 전하 | 0 |
| 복잡도 | 1,340 |
| 물질 분류 | Carcinogens |
| 용해도 | less than 1 mg/mL at 68 °F (NTP, 1992)DMSO(약간 용해됨), 메탄올(약간 용해됨) |
| 녹는점 | 473 to 482 °F (decomposes) (NTP, 1992)245-250°C |
| Physical Description | Benzyl violet 4b is a fine black powder. (NTP, 1992) |
| 저장 조건 | Amber Vial, -20°C Freezer, Under inert atmosphere |
| 물리적 상태 | Solid |
| 색상 | 파란색 |
| 안정성 | 강한 산화제와 호환되지 않습니다. |
| EPA | C.I. Acid Violet 49 (1694-09-3) |
화학적 성질
powder
안전 및 규제
| GHS 분류 | WarningH351: Suspected of causing cancer [Warning Carcinogenicity]P203, P280, P318, P405, and P501 (click each P-code to see the statement)DangerH301: Toxic if swallowed [Danger Acute toxicity, oral]P203, P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P318, P321, P330, P405, and P501 (click each P-code to see the statement) |
|---|---|
| 규제 정보 | Hazard Traits - CarcinogenicityThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.) |
| 화재 위험 | Flash point data for this chemical are not availablehowever, it is probably combustible. (NTP, 1992) |
| 건강 유해성 | ACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits very toxic fumes of nitrogen oxides, ammonia, sodium oxide and sulfur oxides. (NTP, 1992) |
| 반응성 그룹 | Amines, Phosphines, and Pyridines |
| Reactivity Profile | BENZYL VIOLET 4B neutralizes acids in weakly exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. May generate hydrogen, a flammable gas, in combination with strong reducing agents such as hydrides. |
| Air and Water Reactions | Insoluble in water. |
| Hazard Classes and Categories | Acute toxicity - category 3CarcinogensCarc. 2 |
| 소화 | Fires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992) |
| 응급 처치 | EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop. |
용도
일반 설명
Fine black powder.