4-Nitrophthalonitrile
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4-Nitrophthalonitrile 속성
- 녹는점
- 142-144 °C(lit.)
- 끓는 점
- 303.75°C (rough estimate)
- 밀도
- 1.4553 (rough estimate)
- 굴절률
- 1.6500 (estimate)
- 저장 조건
- Sealed in dry,Room Temperature
- 물리적 상태
- 결정질 분말, 결정 및/또는 덩어리
- 색상
- 밝은 노란색, 밝은 녹색 또는 밝은 회색에서 베이지색
- 수용성
- 물에 난용성.(0.26 g/L) (25°C),
- BRN
- 1877554
- 주요 응용
- 진단 검사 제조
혈액학
조직학
- InChI
- InChI=1S/C8H3N3O2/c9-4-6-1-2-8(11(12)13)3-7(6)5-10/h1-3H
- InChIKey
- NTZMSBAAHBICLE-UHFFFAOYSA-N
- SMILES
- C1(C#N)=CC=C([N+]([O-])=O)C=C1C#N
- CAS 데이터베이스
- 31643-49-9(CAS DataBase Reference)
안전
- 위험 및 안전 성명
- 위험 및 사전주의 사항 (GHS)
| 위험품 표기 | Xn | ||
|---|---|---|---|
| 위험 카페고리 넘버 | 22-36/37/38-20/21/22 | ||
| 안전지침서 | 26-36 | ||
| WGK 독일 | 3 | ||
| RTECS 번호 | TI8576000 | ||
| TSCA | TSCA listed | ||
| HS 번호 | 29269090 | ||
| 스토리지 클래스 | 11 - Combustible Solids | ||
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
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| 독성 | mouse,LD50,oral,500mg/kg (500mg/kg),SENSE ORGANS AND SPECIAL SENSES: OTHER CHANGES: OLFACTIONBEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION,Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 52(9), Pg. 92, 1987. |
4-Nitrophthalonitrile C화학적 특성, 용도, 생산
화학적 성질
light yellow, light greenish or light grey to용도
4-Nitrophthalonitrile is a useful chemical in organic synthesis. Dyes and metabolites.제조 방법
Synthesis of 4-Nitrophthalonitrile: SOCl2 (83.5 mL. 1.144 mol) was added dropwise under nitrogen purge to dry DMF (200 mL) which had been cooled to 0-5 °C. The solution was allowed to stir for 15 min at 0-5 °C. The 4-nitrophthalamide (60.1 g, 0.286 mol) was then added and the solution was allowed to slowly warm to room temperature and react for 18 h under nitrogen purge. The solution was then slowly added to ice water to crystallize and precipitate the product. The 4-nitrophthalonitrile was collected using vacuum filtration, washed with ice cold water, and allowed to air dry overnight; yield: 45.2 g (92%); m.p.: 141 °C (det. by DSC)1 H NMR((CD3)2SO): 8.41 (dd, 1H), 8.67 (dd, 1H), 9.03 (dd, 1H) FTIR: 3091 (m, aromatic C-H stretch), 2242 (d, CN stretch), 1534 (s, asymmetric N=O stretch), 1349 (s, symmetric N=O stretch), 853 (s, C-N stretch)
Synthesis
4-Nitrophthalonitrile synthesized from phthalimide in three steps. The reaction time of ruthenium chloride and HZSM-5 catalysts was very shorter than ammonium molybdate and Hβ catalysts. The yield while we used ruthenium chloride and HZSM-5 catalysts were very higher than another.
In a three necked flask, 70 mL of dry dimethylformamide (DMF) was cooled to 0 °C under a stream of nitrogen and 7.3 mL of thionyl chloride was added so that the internal temperature did not go beyond 5 °C. After addition, nitrogen flow was ceased and a calcium chloride tube was added to the top of flask. Meanwhile, the color of the medium was observed to be yellow. Then, 10 g (0.048 mol) of 4- nitrophthalamide was slowly added so that the internal temperature did not go beyond 5 °C. The mixture was stirred over ice bath for 1 hour. The mixture was stirred at room temperature for 2 hours and then poured over 500 g of ice-water. The precipitate was filtered and washed successively with water, 250 mL 5% sodium hydrogencarbonate solution, and water again and dried in a vacuum oven at 110-120 °C. Molecular formula: C8H3N3O2. Yield: 7.4 g (90%). Mp: 141 °C.
4-Nitrophthalonitrile 준비 용품 및 원자재
원자재
1H-Isoindol-1-one, 3-hydroxy-
1,2-벤젠디카르보닐이염화물,4-니트로-
3-Nitrophthalonitrile
4-니트로프탈디아미드
4-Nitrophthalimide
1,2-벤젠다이카보나이트릴
4-나이트로프탈산
트리플루오로초산 무수물
물
1.4-다이옥세인
준비 용품
4-Nitrophthalonitrile 공급 업체
글로벌( 558)공급 업체
| 공급자 | 전화 | 이메일 | 국가 | 제품 수 | 이점 |
|---|---|---|---|---|---|
| Hubei XinghengKang Chemical Technology Co., Ltd. | 027-88878869 18162384755 |
xhkhu2014@163.com | China | 240 | 58 |
| Shanghai Taijilin Industrial Co., Ltd. | 02150630626 17717886015 |
kate@tajilin.com | China | 1342 | 58 |
| Jinan Dexinjia Bio&Tech Co., Ltd | 0531-82375818 15064153060 |
1329217348@qq.com | China | 1446 | 58 |
| Nantong Xiaochang Pharmaceutical Trading Co., Ltd. | 0513-82104991 18862997351 |
sales11@btcpharm.com | China | 859 | 58 |
| Jiangsu 01 Industrial Co., Ltd | 0523-87653988 15105181882 |
519181683@qq.com | China | 131 | 58 |
| Changsha Changtang Import and Export Co., LTD | 19310125487 19310125487 |
1761256297@qq.com | China | 995 | 58 |
| SHANDONG XINGRUNDA CHEMICAL CO.,LTD | 0534-18615348689 18615348689 |
hclt1978@163.com | China | 35 | 58 |
| Shanghai Boyle Chemical Co., Ltd. | 021-50182298 021-50180596 |
sales@boylechem.com | China | 2202 | 55 |
| J & K SCIENTIFIC LTD. | 18210857532 18210857532 |
jkinfo@jkchemical.com | China | 96815 | 76 |
| Changzhou Sunchem Pharmaceutical Chemical Material Co.,Ltd. | 0519-85195575 15861192208;15861192208;13685253038 |
850305@sunkechem.com | China | 69 | 69 |
4-Nitrophthalonitrile 관련 검색:
4-나이트로프탈산 4-이소부톡시-벤잘데하이드 2-하이드록시-티오벤자미드 3-아미노벤조나이트릴 4-아미노벤조니트릴 1,2-벤젠다이카보나이트릴 이소프탈로니트릴 2-메틸-5-니트로벤조니트릴 3-니트로벤조니트릴 2-메틸-4-니트로벤조니트릴98
isopropyl 2-(3-cyano-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate
Febuxostat Impurity 8
4-(2-Methylpropoxy)-1,3-benzenedicarbothioaMide
Febuxostat impurity 37
FeBuxostat Impurity 33
3-Cyano-4-isobutoxybenzoic acid
ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl thiazole-5-carboxylate
Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate




