Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
2-클로로-1,1'-바이페닐
아로클로르1242 · 2-클로로-1,1'-바이페닐 · 2-Chloro-1,1'-biphenyl · 2-PCB · PCB 1 · BZNO 1 · PCB NO 1 · NSC 67354

식별자 및 물리적 특성
| CAS No. | 11141-16-5 |
|---|---|
| 분자식 | C12H9Cl |
| 평균 분자량 | 188.65 g/mol |
| 단동위원소 질량 | 188.03927797 g/mol |
| SMILES | Clc1ccccc1-c1ccccc1 |
| InChIKey | LAXBNTIAOJWAOP-UHFFFAOYSA-N |
| PubChem CID | 249266 |
| ChEMBL | CHEMBL191745 |
| ChEBI | CHEBI:34269 |
| EC No. | 218-125-6 |
| DTXSID | DTXSID6040298 |
| 현지명 | 2-클로로-1,1'-바이페닐 |
화학 및 물리적 성질
| XLogP | 4.5 |
|---|---|
| 극성 표면적 | 0 |
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 0 |
| 회전 가능 결합 수 | 1 |
| 무거운 원자 수 | 13 |
| 형식 전하 | 0 |
| 복잡도 | 149 |
| 물질 분류 | PCB |
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
| LogP(분배 계수) | log Kow = >4.54 |
| 밀도 | 1.270-1.280/15.5 °C1.44 @ 30°C1.1499 g/cm3 (32.5 ºC) |
| Viscosity | Saybolt sec at 37.8 °C39-41 Saybolt sec at 54.4 °C31-32 Saybolt sec at 98.9 °C |
| Color/Form | Clear oil... Colorless mobile oilLower chlorinated Aroclors (1221, 1232, 1016, 1242, and 1248) are colorless mobile oils. Increasing chlorine content results in mixtures taking on the consistency of viscous liquids (Aroclor 1254) or sticky resins (Aroclors 1260 and 1262). Arclors 1268 and 1270 are white powders. |
| 용해도 | Solubility in water varies because Aroclors are variable mixtures.In water, 1.45 mg/L at 25 °C클로로포름, DMSO(약간 용해됨), 메탄올(약간 용해됨) |
| 인화점 | 286 °F (NTP, 1992)152-154 °CCleveland open cup |
| 끓는 점 | 554 to 617 °F at 760 mmHg (NTP, 1992)290-325 °C274℃ |
| Decomposition | When heated to decomposition they emit toxic fumes of Chlorine. /Polychlorinated biphenyls/ |
| 증기압 | 4.06X10-3 mm Hg at 25 °C |
| 굴절률 | Index of refraction at 20 °C = 1.620 to 1.6221.5830 (estimate) |
| 녹는점 | 32-34 |
| 저장 조건 | Room Temperature |
| 색상 | 흰색에서 연한 노란색 |
| 용해도 | 7.8mg/L(25℃) |
| BRN | 1907934 |
| 헨리 상수 | 3.0×10-2 mol/(m3Pa) at 25℃, Lau et al. (2006) |
| 안정성 | 안정적인. 강한 산화제와 호환되지 않습니다. |
| InChI | InChI=1S/C12H9Cl/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H |
| InChIKey | LAXBNTIAOJWAOP-UHFFFAOYSA-N |
| SMILES | C1(C2=CC=CC=C2)=CC=CC=C1Cl |
| EPA | 2-Chlorobiphenyl (2051-60-7) |
화학적 성질
powder
안전 및 규제
| GHS 분류 | WarningH373 (97.7%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]P260, P273, P319, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 43 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.This chemical does not meet GHS hazard criteria for 2.4% (1 of 42) of reports. |
|---|---|
| 규제 정보 | Hazard Traits - Environmental toxSubstance: Chloro-1,1'-biphenylSubstance: 2-chlorobiphenyl |
| 운송 라벨(DOT) | Class 9 |
| 화재 위험 | Excerpt from ERG Guide 171 [Substances (Low to Moderate Hazard)]: |
| 화재 가능성 | PCBs may burn but do not easily ignite. /Polychlorinated biphenyls/ |
| 건강 유해성 | ACUTE/CHRONIC HAZARDS: Toxic irritant. Hazardous decomposition products. (NTP, 1992) |
| 반응성 그룹 | Aryl Halides |
| Special Reports | WHOEnvironmental Health Criteria No. 140: Polychlorniated Biphenyls and Terphenyls (1993). EHC are designed for scientists and administrators responsible for the establishment of safety standards and regulations and provide basic scientific risk evaluations of a wide range of chemicals and groups of chemicals.[Available from, as of June 30, 2010: http://www.inchem.org/documents/ehc/ehc/ehc140.htm]U.S. Dept Health & Human Services/Agency for Toxic Substances & Disease RegistryToxicological Profile for Polychlorinated biphenyls (PCBs) (November 2000). The ATSDR toxicological profile succinctly characterizes the toxicologic and adverse health effects information for a hazardous substance.[Available from, as of June 16, 2010: http://www.atsdr.cdc.gov/toxprofiles/index.asp]TSCA CHIPs present a preliminary assessment of polychlorinated biphenyl's potential for injury to human health & the environment (available at EPA's TSCA Assistance Office: (202) 554-1404Safe SCrit Rev Toxicol 13 (4): 319-95 (1984). Polychlorinated Biphenyls and Polybrominated Biphenyls Biochemistry Toxicology and Mechanism of Action. |
용도
용도
2-Chlorobiphenyl can be used to treat TP receptor antagonists.