Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HCID 9178생성일: 2026년 11월 2일
디벤즈[C,H]아크리딘
디벤즈[C,H]아크리딘 · C460375 · DIBENZ[C,H]ACRIDINE · 14-azadibenz(a,j)anthracene · Dibenz[c,h]acridine (purity) · Dibenz[c,h]acridine in toluene · 52334, Dibenz[c,h]acridine (purity)
https://huagongshe.com/ko/chemical/9178
식별자 및 물리적 특성
| CAS No. | 224-53-3 |
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| 분자식 | C21H13N |
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| 평균 분자량 | 279.3 g/mol |
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| 단동위원소 질량 | 279.10479942 g/mol |
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| SMILES | c1ccc2c(c1)ccc1cc3ccc4ccccc4c3nc12 |
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| InChIKey | BTVBCAKHMZHLFR-UHFFFAOYSA-N |
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| PubChem CID | 9178 |
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| ChEBI | CHEBI:196267 |
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| EC No. | 681-926-8 |
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| DTXSID | DTXSID30176929 |
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| 현지명 | 디벤즈[C,H]아크리딘 |
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화학 및 물리적 성질
| XLogP | 6 |
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| 극성 표면적 | 12.9 |
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| 수소 결합 공여자 수 | 0 |
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| 수소 결합 수용자 수 | 1 |
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| 회전 가능 결합 수 | 0 |
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| 무거운 원자 수 | 22 |
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| 형식 전하 | 0 |
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| 복잡도 | 369 |
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| Polymers | Other Classes -> Polycyclic Aromatic Hydrocarbons |
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| SpringerMaterials Properties | Angular frequency |
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| LogP(분배 계수) | 6.42 |
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| 녹는점 | 189°C |
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| 끓는 점 | 412.11°C (rough estimate) |
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| 밀도 | 1.0343 (rough estimate) |
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| 굴절률 | 1.8240 (estimate) |
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| 저장 조건 | 2-8°C |
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| pKa(산도 계수) | 4.25±0.30(Predicted) |
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| 용해도 | 19.55ug/L(22℃) |
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| BRN | 209259 |
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안전 및 규제
| GHS 분류 | WarningH371 (92.3%): May cause damage to organs [Warning Specific target organ toxicity, single exposure]P260, P264, P270, P308+P316, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 13 reports by companies from 2 notifications to the ECHA C&L Inventory. |
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| 규제 정보 | Hazard Traits - Carcinogenicity |
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| 유해성 요약 | Evidence of mutagenicity in Salmonella typhimurium[HSDB] See POLYCYCLIC AROMATIC HYDROCARBONS. |
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| Hazard Classes and Categories | STOT SE 2 (92.3%) |
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| 유해 작용 | IARC Carcinogen - Class 3: Chemicals are not classifiable by the International Agency for Research on Cancer. |
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| Artificial Pollution Sources | FORMED FROM INCOMPLETE COMBUSTION OF ORGANIC MATERIALS (EG, REFUSE BURNING, OPERATION OF MOTOR VEHICLES, INDUST PROCESSES) |
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| Carcinogen Classification | Dibenz[c,h]acridineGroup 2B: Possibly carcinogenic to humansVolume 103: (2013) Bitumens and Bitumen Emissions, and some N- and S-Heterocyclic Aromatic Hydrocarbons2011NB Overall evaluation upgraded to Group 2B with supporting evidence from other relevant data |
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| Non-Human Toxicity Excerpts | ACTIVITIES OF SOME CARCINOGENIC HETEROCYCLIC COMPD: DIBENZ(C,H)ACRIDINE, SLIGHT. /FROM TABLE/3,4,5,6-DIBENZACRIDINE-INDUCTION OF REVERTANTS IN 4 TEST STRAINS OF S TYPHIMURIUM. TEST RESULT: POS. |
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| 유해 물질 데이터 | 224-53-3(Hazardous Substances Data) |
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![디벤즈[C,H]아크리딘 분자 구조식](/img/chemical/9178.png)