1,5-Diaminoanthraquinone
1,5-diaminoanthracene-9,10-dione · 92.0%(N) · smokeredf · TIMTEC-BB SBB000769 · 1,5-DIAMINOATHRAQUINONE · ,5-DIAMINOANTHRAQUINONE · 1,5-diaminoanthrachinon · 1,5-diamino-anthraquinon
식별자 및 물리적 특성
| CAS No. | 129-44-2 |
|---|---|
| 분자식 | C14H10N2O2 |
| 평균 분자량 | 238.24 g/mol |
| 단동위원소 질량 | 238.07422757 g/mol |
| SMILES | Nc1cccc2c1C(=O)c1cccc(N)c1C2=O |
| InChIKey | VWBVCOPVKXNMMZ-UHFFFAOYSA-N |
| PubChem CID | 8513 |
| ChEMBL | CHEMBL90387 |
| EC No. | 204-947-2 |
| DTXSID | DTXSID1059602 |
화학 및 물리적 성질
| XLogP | 2.6 |
|---|---|
| 극성 표면적 | 86.2 |
| 수소 결합 공여자 수 | 2 |
| 수소 결합 수용자 수 | 4 |
| 회전 가능 결합 수 | 0 |
| 무거운 원자 수 | 18 |
| 형식 전하 | 0 |
| 복잡도 | 346 |
| Physical Description | Red odorless powder[Alfa Aesar MSDS] |
| 녹는점 | >300 °C (lit.) |
| 끓는 점 | 380.84°C (rough estimate) |
| 밀도 | 1.1907 (rough estimate) |
| 굴절률 | 1.6500 (estimate) |
| 저장 조건 | Keep in dark place,Sealed in dry,Room Temperature |
| 물리적 상태 | powder to crystaline |
| pKa(산도 계수) | -0.66±0.20(Predicted) |
| 색상 | Orange to Brown to Dark red |
| 용해도 | 물에 불용성. |
| InChI | InChI=1S/C14H10N2O2/c15-9-5-1-3-7-11(9)14(18)8-4-2-6-10(16)12(8)13(7)17/h1-6H,15-16H2 |
| InChIKey | VWBVCOPVKXNMMZ-UHFFFAOYSA-N |
| SMILES | C1(N)=C2C(C(=O)C3=C(C2=O)C=CC=C3N)=CC=C1 |
| EPA | 9,10-Anthracenedione, 1,5-diamino- (129-44-2) |
안전 및 규제
| GHS 분류 | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| 규제 정보 | Chemical: 9,10-Anthracenedione, 1,5-diamino- |
| 유해성 요약 | A mild eye irritantCauses liver, cardiac, and renal tubular changes in 10-day oral studies of rats[RTECS] May cause eye irritation[Alfa Aesar MSDS] See 1-Amino-2-methylanthraquinone. |
| Hazard Classes and Categories | Skin Irrit. 2 (100%)Eye Irrit. 2 (100%)STOT SE 3 (97.7%) |
| 수질 위해 등급(WGK) | 3 |
| TSCA 등재 상태 | TSCA listed |
| RTECS 번호 | CB6400000 |
| 관세 코드 | 29147000 |
| 위험 문구(R) | 36/37/38 |
| 위험 표시 | Xi |
| 안전 문구(S) | 26-37/39 |
| 위험 등급 | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
| 저장 분류 | 11 - Combustible Solids |
용도
용도
1,5-Diaminoanthraquinone (DAAQ) may be used in the preparation of vertical nanowire arrays. It may be used in the synthesis of poly(1,5-diaminoanthraquinone) (PDAA) particles, via chemically oxidative polymerization of DAAQ.
일반 설명
1,5-Diaminoanthraquinone (DAAQ) is an organic dye compound. Rapid preparation of 1,5-diaminoanthraquinone nanofibers (DAAQNFs) decorated with small platinum nanoparticles (PtNPs) has been reported. The absorption and fluorescence spectra of DAAQ has been investigated in various organic solvents. Preparation of vertical organic nanowire arrays of DAAQ on solid substrates by a facile physical vapor transport method has been reported.