기본 정보
- CAS
52372-36-8- 표준 SMILES
CCN(CC)c1ccc2cc3c(oc2c1)c(C#N)c(=O)n1c2ccccc2nc31- InChIKey
UTTFXJZCRVZYQF-UHFFFAOYSA-N- 분자식
- C23H18N4O2
- 평균 분자량
- 382.4 g/mol
- 단동위원소 질량
- 382.14297583
이름 및 식별자
- 우선 이름
- 7H-(1)Benzopyrano(3',2':3,4)pyrido(1,2-a)benzimidazole-6-carbonitrile, 3-(diethylamino)-7-oxo-
- IUPAC
- 17-(diethylamino)-11-oxo-14-oxa-3,10-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(21),2,4,6,8,12,15(20),16,18-nonaene-12-carbonitrile
- 현지명
- 3-(디에틸아미노)-7-옥소-7H-[1]벤조피라노[3,2:3,4]피리노[1,2-a]벤지이미다졸-6-카보니트릴
- 영어명
- Solvent Red 196
- 분자식
- C23H18N4O2
- 분자량
- 382.41
이름 및 동의어
3-(Diethylamino)-7-oxo-7H-(1)benzopyrano(3',2':3,4)pyrido(1,2-a)benzimidazole-6-carbonitrile7H-[1]Benzopyrano[3',2':3,4]pyrido[1,2-a]benzimidazole-6-carbonitrile, 3-(diethylamino)-7-oxo-3-(Diethylamino)-7-oxo-7H-[1]benzopyrano[3',2':3,4]pyrido[1,2-a]benzimidazole-6-carbonitrileEINECS 257-884-8DTXSID40687497H-(1)Benzopyrano(3',2':3,4)pyrido(1,2-a)benzimidazole-6-carbonitrile, 3-(diethylamino)-7-oxo-RefChem:106655DTXCID1041184257-884-8Solvent Red 19652372-36-83-(Diethylamino)-7-oxo-7H-benzo[4,5]imidazo[1,2-a]chromeno[3,2-c]pyridine-6-carbonitrile
이름 더 보기
3-(디에틸아미노)-7-옥소-7H-[1]벤조피라노[3,2:3,4]피리노[1,2-a]벤지이미다졸-6-카보니트릴Red FBKDisperse Red BGPolysolve Red 196Rosaplast Red F2M.FLUORESCENCE RED BK
17-(diethylamino)-11-oxo-14-oxa-3,10-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(21),2,4,6,8,12,15(20),16,18-nonaene-12-carbonitrileC.I.Solvent Red 196C23H18N4O2Red FBKstarbld0009656SOLVENTRED196C.I. 505700Elbaplast Fluorescent Red 2B
물성
구조 계산 물성
- XLogP
- 3.7
- 극성 표면적
- 71.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 805
물리화학적 성질
- 끓는 점
- 575.3 · 575.3±60.0 °C(Predicted)
- 밀도
- 1.34 · 1.34±0.1 g/cm3(Predicted)
- 저장 조건
- 2 · 2-8°C, protect from light
- 산도 계수 (pKa)
- 4.58 · 4.58±0.40(Predicted)
- InChI
- InChI=1S/C23H18N4O2/c1-3-26(4-2)15-10-9-14-11-16-21(29-20(14)12-15)17(13-24)23(28)27-19-8-6-5-7-18(19)25-22(16)27/h5-12H,3-4H2,1-2H3
- InChIKey
- UTTFXJZCRVZYQF-UHFFFAOYSA-N
- SMILES
- C12C3=CC4=CC=C(N(CC)CC)C=C4OC3=C(C#N)C(=O)N1C1=CC=CC=C1N=2
- LogP
- 3.6 at · 3.6 at 25℃
- EPA
- 7 H-[1]Benzopyrano[3',2':3,4]pyrido[1,2-a]benzimidazole-6-carbonitrile, · 7H-[1]Benzopyrano[3',2':3,4]pyrido[1,2-a]benzimidazole-6-carbonitrile, 3-(diethylamino)-7-oxo- (52372-36-8)
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 90.4% (75 of 83) of all reports.
Not Classified
Aggregated GHS information provided per 83 reports by companies from 3 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: 7H-[1]Benzopyrano[3',2':3,4]pyrido[1,2-a]benzimidazole-6-carbonitrile, 3-(diethylamino)-7-oxo-
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: 3-(diethylamino)-7-oxo-7H-[1]benzopyrano[3',2':3,4]pyrido[1,2-a]benzimidazole-6-carbonitrile (EC: 257-884-8)
7H-[1]Benzopyrano[3',2':3,4]pyrido[1,2-a]benzimidazole-6-carbonitrile, 3-(diethylamino)-7-oxo-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
- 기존화학 물질
- KE-10415KE-08633
화학 및 산업
용도 및 제조
General Manufacturing Information7H-[1]Benzopyrano[3',2':3,4]pyrido[1,2-a]benzimidazole-6-carbonitrile, 3-(diethylamino)-7-oxo-: ACTIVE
상·하류 제품 정보
상류 원료
공급사77 곳
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
湖北宥澄新材料科技有限公司17764017698 13163370568 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
湖北盛明安化工有限公司13928406992 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
江苏艾康生物医药研发有限公司
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