기본 정보
- CAS
4702-64-1- 표준 SMILES
COc1ccc(-c2cc(N)c3c(c2O)C(=O)c2c(N)ccc(O)c2C3=O)cc1- InChIKey
OVPZEFAFTQSEJB-UHFFFAOYSA-N- 분자식
- C21H16N2O5
- 평균 분자량
- 376.4 g/mol
- 단동위원소 질량
- 376.10592162
이름 및 식별자
- 우선 이름
- 9,10-Anthracenedione, 4,8-diamino-1,5-dihydroxy-2-(4-methoxyphenyl)-
- IUPAC
- 4,8-diamino-1,5-dihydroxy-2-(4-methoxyphenyl)anthracene-9,10-dione
- 현지명
- 4,8-디아미노-1,5-디히드록시-2-(4-메톡시페닐)안트라퀴논
- 영어명
- 4,8-diamino-1,5-dihydroxy-2-(4-methoxyphenyl)anthraquinone
- 분자식
- C21H16N2O5
- 분자량
- 376.36
이름 및 동의어
4702-64-19,10-Anthracenedione, 4,8-diamino-1,5-dihydroxy-2-(4-methoxyphenyl)-4,8-Diamino-1,5-dihydroxy-2-(4-methoxyphenyl)anthraquinoneEINECS 225-181-52-(4'-Methoxyphenyl)-4,8-diaminoanthrarufinNSC 336252BRN 2786136Anthraquinone, 4,8-diamino-1,5-dihydroxy-2-(p-methoxyphenyl)-1,5-Diamino-4,8-dihydroxy-3-(4-methoxyphenyl)anthraquinone1,5-Diamino-4,8-dihydroxy-3-(p-methoxyphenyl)anthraquinoneDTXSID60521164,8-Diamino-1,5-dihydroxy-2-(4-methoxyphenyl)-9,10-anthracenedione
이름 더 보기
4,8-디아미노-1,5-디히드록시-2-(4-메톡시페닐)안트라퀴논Nsc336252
4,8-Diamino-1,5-dihydroxy-2-(p-methoxyphenyl)anthracen-9,10-dioneANTHRAQUINONE, 1,5-DIAMINO-4,8-DIHYDROXY-3-(p-METHOXYPHENYL)-RefChem:548730DTXCID8030685225-181-5Modr ostacetova Se-lb4,8-diamino-1,5-dihydroxy-2-(4-methoxyphenyl)anthracene-9,10-dioneNSC-336252
데이터베이스 식별자
물성
구조 계산 물성
- XLogP
- 3.5
- 극성 표면적
- 136 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 620
물리화학적 성질
- 끓는 점
- 504.93 °C · 504.93°C (rough estimate)
- 밀도
- 1.358 · 1.3580 (rough estimate)
- 굴절률
- 1.65 · 1.6500 (estimate)
- 산도 계수 (pKa)
- 5.76 · 5.76±0.20(Predicted)
- EPA
- 9 · 9,10-Anthracenedione, 4,8-diamino-1,5-dihydroxy-2-(4-methoxyphenyl)- (4702-64-1)
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% (5 of 5) of all reports.
Not Classified；Reported as not meeting GHS hazard criteria by 5 of 5 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 5 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 5 of 5 reports by companies.；There are 0 notifications provided by 0 of 5 reports by companies with hazard statement code(s).；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.
유해성 정보
Regulatory InformationChemical: 9,10-Anthracenedione, 4,8-diamino-1,5-dihydroxy-2-(4-methoxyphenyl)-
Hazard Classes and CategoriesNot Classified
규제 정보
Regulatory InformationChemical: 9,10-Anthracenedione, 4,8-diamino-1,5-dihydroxy-2-(4-methoxyphenyl)-
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information9,10-Anthracenedione, 4,8-diamino-1,5-dihydroxy-2-(4-methoxyphenyl)-: ACTIVE
관련 반응
1건
화합물 노트
불러오는 중…