Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
메틸옐로우
N,N-디메틸-4-아미노아조벤젠 · 디메틸아미노아조벤젠BENZENAMINE,N,N-DIMETHYL-4-(PHENYLAZO)-4-(DIMETHYLAMINO)AZOBENZENE · 4-디메틸아미노아조벤젠 · ρ-디메틸아미노아조벤젠 · 메틸옐로우 · 메틸옐로우용액 · METHYL YELLOW · Dimethylaminoazobenzene
식별자 및 물리적 특성
| CAS No. | 60-11-7 |
|---|---|
| 분자식 | C14H15N3 |
| 평균 분자량 | 225.29 g/mol |
| 단동위원소 질량 | 225.12659748 g/mol |
| SMILES | CN(C)c1ccc(N=Nc2ccccc2)cc1 |
| InChIKey | JCYPECIVGRXBMO-UHFFFAOYSA-N |
| PubChem CID | 6053 |
| ChEMBL | CHEMBL1090440 |
| ChEBI | CHEBI:17903 |
| EC No. | 200-455-7 |
| DTXSID | DTXSID5020491 |
| 현지명 | 메틸옐로우 |
화학 및 물리적 성질
| XLogP | 4.6 |
|---|---|
| 극성 표면적 | 28 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 3 |
| 회전 가능 결합 수 | 3 |
| 무거운 원자 수 | 17 |
| 형식 전하 | 0 |
| 복잡도 | 236 |
| 물질 분류 | Hazardous Air Pollutants (HAPs)Dyes -> Azo DyesCarcinogens |
| SpringerMaterials Properties | 15N nuclear magnetic resonance spectrum |
| LogP(분배 계수) | log Kow= 4.584.05 |
| Color/Form | YELLOW CRYSTALLINE LEAFLETSYellow, leaf-shaped crystals. |
| 용해도 | less than 1 mg/mL at 72 °F (NTP, 1992)SOL IN ALCOHOL, BENZENE, CHLOROFORMSOL IN ETHER, PETROLEUM ETHER, MINERAL ACIDS, OILS.VERY SOL IN PYRIDINE.Water solubility of 13.6 ppm.Solubility in water: none0.001%물에 불용성에탄올, 벤젠, 에테르, 클로로포름, 석유 에테르, 무기산, 오일에 용해됩니다. |
| 끓는 점 | Sublimes (NIOSH, 2024)356.8°C (rough estimate) |
| 녹는점 | 232 °F (decomposes) (NTP, 1992)114-117 °C237 °F111 °C (dec.)(lit.) |
| 증기 밀도 | 7.78 (NTP, 1992) - Heavier than airwill sink (Relative to Air) |
| 증기압 | 3e-07 mmHg (est.) (NIOSH, 2024)0.0000003 [mmHg]0.0000003 mmHg (est.)3 x 10-7 mmHg (estimated, NIOSH, 1997) |
| 헨리 상수 | Henry's Law constant= 7.1X10-9 atm-cu m/mol (calculated).1.4×103 mol/(m3Pa) at 25℃, HSDB (2015) |
| Physical Description | 4-dimethylaminoazobenzene appears as yellow crystalline leaflets or an orange powder. (NTP, 1992)Yellow, leaf-shaped crystals[NIOSH]YELLOW CRYSTALS.Yellow, leaf-shaped crystals. |
| 밀도 | 1.1303 (rough estimate) |
| 굴절률 | 1.5770 (estimate) |
| 저장 조건 | Store at RT. |
| pKa(산도 계수) | 3.226(at 25℃) |
| 물리적 상태 | 가루 |
| 색상 | 노란색 |
| pH | 2.9-4.0 |
| 용해도 | 13.6mg/L |
| Merck | 14,3229 |
| BRN | 746016 |
| 안정성 | 안정적이지만 열과 빛에 민감합니다. 강한 산화제, 강산과 호환되지 않습니다. |
| 주요 응용 | 전기변색 재료, 졸-겔 코팅, 디스플레이 장치, 잉크, 가스 감지 장치, 상태 평가 감지 장치, 살선충제, 염색약, 기저귀, 식품 보관, 유방암 상태 평가, 탄수화물 검출, 박테리아 검출, 자궁경부 질환 진단, 상처 드레싱 재료 |
| InChI | 1S/C14H15N3/c1-17(2)14-10-8-13(9-11-14)16-15-12-6-4-3-5-7-12/h3-11H,1-2H3 |
| InChIKey | JCYPECIVGRXBMO-UHFFFAOYSA-N |
| SMILES | CN(C)c1ccc(cc1)N=Nc2ccccc2 |
| NIST | Benzenamine, N,N-dimethyl-4-(phenylazo)-(60-11-7) |
| EPA | 4-Dimethylaminoazobenzene (60-11-7) |
화학적 성질
yellow to orange crystalline powder
안전 및 규제
| GHS 분류 | DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P203, P264, P270, P280, P301+P316, P318, P321, P330, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 52 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.WarningH315: Causes skin irritation [Warning Skin corrosion/irritation] |
|---|---|
| 규제 정보 | Chemical: Benzenamine, N,N-dimethyl-4-(phenylazo)-Hazard Traits - CarcinogenicityDermatotoxicityRegulation (EC) No 178/2002 (amended)C.I. Solvent Yellow 2: Does not have an individual approval but may be used under an appropriate group standardThe 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.) |
| 기타 안전 정보 | IMAP assessments - Benzenamine, N,N-dimethyl-4-(phenylazo)-: Environment tier I assessment |
| 운송 라벨(DOT) | Poison |
| 화재 위험 | Flash point data for this chemical are not available. It is probably combustible. (NTP, 1992)Not combustible. |
| 건강 유해성 | Excerpt from NIOSH Pocket Guide for 4-Dimethylaminoazobenzene: |
| 유해성 요약 | 4-Dimethylaminoazobenzene is used as a dye for coloring polishes, wax products, and soap. Acute (short- term) dermal exposure to 4-dimethylaminoazobenzene may result in contact dermatitis in humans. No information is available on the chronic (long-term), reproductive, developmental, or carcinogenic effects of 4-dimethylaminoazobenzene in humans. Animal studies have reported birth defects in the offspring of mice exposed to 4-dimethylaminoazobenzene and tumors of the lung, liver, and bladder from oral exposure to 4-dimethylaminoazobenzene. EPA has not classified 4-dimethylaminoazobenzene for carcinogenicity. The International Agency for Research on Cancer (IARC) has classified 4- dimethylaminoazobenzene as a Group 2B, possibly carcinogenic to humans.In animal studies: liver injuryIn feeding studies of dogs: bladder cancer[HSDB] |
용도
개요
4-N,N-Dimethylaminobenzene diazonium chloride is a diazo compound found in diazo copy paper. It is allergenic only when unexposed.
용도
For determination of free HCl in gastric juice; spot test identification of peroxidized fats; pH indicator (red 2.9, yellow 4.0).
일반 설명
Yellow crystalline leaflets or an orange powder.
제조 및 합성 방법
생산 방법
4-Dimethylaminoazobenzene was produced in large quantities in the early 1900s but is currently not produced in any significant commercial quantity in the United States.
제조 방법
aniline diazotization, and N,N-dimethylaniline coupling.