기본 정보
- 표준 SMILES
CNc1ccc(Br)c2c1C(=O)c1ccccc1C2=O- InChIKey
IIPRUQZTMZETSL-UHFFFAOYSA-N- 분자식
- C15H10BrNO2
- 평균 분자량
- 316.15 g/mol
- 단동위원소 질량
- 314.98949066
이름 및 식별자
- 우선 이름
- 9,10-Anthracenedione, 1-bromo-4-(methylamino)-
- IUPAC
- 1-bromo-4-(methylamino)anthracene-9,10-dione
- 현지명
- 1-메틸아미노-4-브로모안트라퀴논
- 영어명
- 1-Methylamino-4-bromo anthraquinone
- 분자식
- C15H10BrNO2
- 분자량
- 316.15
이름 및 동의어
128-93-89,10-Anthracenedione, 1-bromo-4-(methylamino)-1-Bromo-4-(methylamino)anthraquinone1-(Methylamino)-4-bromoanthraquinone1-Methylamino-4-bromanthrachinonAI3-18875EINECS 204-920-5NSC 39941ANTHRAQUINONE, 1-BROMO-4-(METHYLAMINO)-BRN 18433361-Methylamino-4-bromanthrachinon [Czech]DTXSID4059590
이름 더 보기
1-메틸아미노-4-브로모안트라퀴논4-BROMO-1-(METHYLAMINO)ANTHRAQUINONE1-MethylaMino-4-broM1-Methylamine-4-Bromoanthraquinone1-bromo-4-(methylamino)-anthraquinon4-Bromo-1-(methylamine)anthraquinoneAnthraquinone, 1-MethylaMino-4-broMo-1-bromo-4-(methylamino)-9,10-anthraquinone
4-14-00-00443 (Beilstein Handbook Reference)RefChem:5486991-bromo-4-(methylamino)-9,10-anthracenedioneDTXCID0033914204-920-51-bromo-4-(methylamino)anthracene-9,10-dione1-Methylamino-4-bromo anthraquinone1-Bromo-4-methylamino-anthraquinone
데이터베이스 식별자
- CAS
128-93-8- PubChem CID
- 31418
- DTXSID
DTXSID4059590- UNII
- UNE5XB7QKP
- EC Number
- 204-920-5
- Nikkaji
- J31.592C
물성
구조 계산 물성
- XLogP
- 4.1
- 극성 표면적
- 46.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 398
물리화학적 성질
- 녹는점
- 195.5 °C · 195.5°C
- 끓는 점
- 510.1 · 510.1±50.0 °C(Predicted)
- 밀도
- 1.5512 · 1.5512 (rough estimate)
- 굴절률
- 1.632 · 1.6320 (estimate)
- 저장 조건
- 2 · Storage temp. 2-8°C
- 산도 계수 (pKa)
- 1.41 · 1.41±0.20(Predicted)
- InChI
- InChI=1S/C15H10BrNO2/c1-17-11-7-6-10(16)12-13(11)15(19)9-5-3-2-4-8(9)14(12)18/h2-7,17H,1H3
- InChIKey
- IIPRUQZTMZETSL-UHFFFAOYSA-N
- SMILES
- C1(Br)=C2C(C(=O)C3=C(C2=O)C=CC=C3)=C(NC)C=C1
- EPA
- 9 · 9,10-Anthracenedione, 1-bromo-4-(methylamino)- (128-93-8)
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 94.9% (37 of 39) of all reports.
Not Classified
Aggregated GHS information provided per 39 reports by companies from 3 notifications to the ECHA C&L Inventory.
유해성 정보
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information9,10-Anthracenedione, 1-bromo-4-(methylamino)-: INACTIVE
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
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Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
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淮安嘉目生物科技有限公司0517-83187139 18205232085 · [email protected]
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常州布克化工有限公司13606129753 13775119556 · [email protected]
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上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
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Alfa Chemistry1-516-6625404 · [email protected]
Henan Alfa Chemical Co., Ltd+8618339805032 · [email protected]
上海威尔舒氪医药科技有限公司15250615384
武汉沃轩科技有限公司13322067656 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
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