기본 정보
- CAS
81-85-6- 표준 SMILES
Cn1c(=O)cc2c3c(c(Br)ccc31)C(=O)c1ccccc1-2- InChIKey
QTNAUUGQZYCWGQ-UHFFFAOYSA-N- 분자식
- C17H10BrNO2
- 평균 분자량
- 340.2 g/mol
- 단동위원소 질량
- 338.98949
이름 및 식별자
- 우선 이름
- 3H-Naphtho[1,2,3-de]quinoline-2,7-dione, 6-bromo-3-methyl-
- IUPAC
- 10-bromo-14-methyl-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17)-heptaene-8,15-dione
- 현지명
- 6-브로모-3-메틸-3H-디벤즈[f,ij]이소퀴놀린-2,7-디온
- 영어명
- 6-bromo-3-methyl-3H-dibenz[f,ij]isoquinoline-2,7-dione
- 분자식
- C17H10BrNO2
- 분자량
- 340.17
이름 및 동의어
6-Bromo-3-methyl-3H-dibenz[f,ij]isoquinoline-2,7-dione6-Bromo-3-methyl-3H-naphtho[1,2,3-de]quinoline-2,7-dioneEINECS 201-381-83H-Dibenz[f,ij]isoquinoline-2,7-dione, 6-bromo-3-methyl-3H-Dibenz(f,ij)isoquinoline-2,7-dione, 6-bromo-3-methyl-3H-Naphtho(1,2,3-de)quinoline-2,7-dione, 6-bromo-3-methyl-3H-Naphtho[1,2,3-de]quinoline-2,7-dione, 6-bromo-3-methyl-6-Bromo-3-methyl-3H-dibenz(f,ij)isoquinoline-2,7-dione6-Bromo-3-methyl-3H-naphtho(1,2,3-de)quinoline-2,7-dioneRefChem:505757201-381-881-85-6
이름 더 보기
6-브로모-3-메틸-3H-디벤즈[f,ij]이소퀴놀린-2,7-디온6-Brom-3-methyl-3H-dibenz[f,ij]isochinolin-2,7-dion3-Methyl-6-bromo-7H-dibenz[f,ij]isoquinoline-2,7(3H)-dione6-Bromo-2,3-dihydro-3-methyl-7H-dibenz[f,ij]isoquinoline-2,7-dione
6-bromo-3-methyl-2H-naphtho[1,2,3-de]quinoline-2,7(3H)-dione10-bromo-14-methyl-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17)-heptaene-8,15-dioneF0020-1981C17H10BrNO2ChemDiv1_023986BM8D2P3VV2bromo-hydroxy-methyl-[?]oneOprea1_211150
물성
구조 계산 물성
- XLogP
- 2.9
- 극성 표면적
- 37.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 529
물리화학적 성질
- 녹는점
- 282 °C · 282 °C
- 끓는 점
- 528.7 · 528.7±50.0 °C(Predicted)
- 밀도
- 0.399 g/cm3 · 0.399g/cm3
- 증기압
- 0 · 0-0Pa at 25℃
- 물리적 상태
- Solid:particulate/powder
- 산도 계수 (pKa)
- -2.16 · -2.16±0.20(Predicted)
- InChI
- 1S/C17H10BrNO2/c1-19-13-7-6-12(18)16-15(13)11(8-14(19)20)9-4-2-3-5-10(9)17(16)21/h2-8H,1H3
- SMILES
- O=C1C2=C(Br)C=CC(N3C)=C2C(C4=CC=CC=C41)=CC3=O
- LogP
- 2.45 · 2.45
- EPA
- 3 H-Dibenz[f,ij]isoquinoline-2,7-dione, · 3H-Dibenz[f,ij]isoquinoline-2,7-dione, 6-bromo-3-methyl- (81-85-6)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.
Not Classified
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationREACH registered substance: 6-bromo-3-methyl-3H-dibenz[f,ij]isoquinoline-2,7-dione (EC: 201-381-8)
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information3H-Naphtho[1,2,3-de]quinoline-2,7-dione, 6-bromo-3-methyl-: INACTIVE
응용 분야
용도6-Bromo-3-methyl anthrapyridone is an important intermediate for manufacturing dyes soluble in organic solvents.
상·하류 제품 정보
하류 제품
공급사15 곳
南京凯美西化工有限公司02558748998 18951874644 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
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