2-Bromo-9H-fluorene
기본 정보
- CAS
1133-80-8- 표준 SMILES
Brc1ccc2c(c1)Cc1ccccc1-2- InChIKey
FXSCJZNMWILAJO-UHFFFAOYSA-N- 분자식
- C13H9Br
- 평균 분자량
- 245.11 g/mol
- 단동위원소 질량
- 243.98876239
이름 및 식별자
- 우선 이름
- 2-Bromo-9H-fluorene
- IUPAC
- 2-bromo-9H-fluorene
- 영어명
- 2-Bromofluorene
- 분자식
- C13H9Br
- 분자량
- 245.11
이름 및 동의어
2-Bromofluorene2-BROMO-9H-FLUORENE9H-Fluorene, 2-bromo-EINECS 214-480-6AI3-00816DTXSID00150357NSC 14632Bromo9Hfluorene9HFluorene, 2bromoRefChem:467114DTXCID1072848214-480-6
이름 더 보기
EAFC2-BromofL2-Brom-fluoren2-Bromofluorene>2-Bromofluorene 95%2-Bromofluorene,95%2-broMo-2H-fluorene
InChI=1/C13H9Br/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H1133-80-8MFCD00001115J2DF3P68J29H-Fluorene,2-bromo2-Bromo-9H-fluorene #SCHEMBL415882NSC-1463
데이터베이스 식별자
- CAS
1133-80-8- PubChem CID
- 14336
- DTXSID
DTXSID00150357- UNII
- J2DF3P68J2
- EC Number
- 214-480-6
- Nikkaji
- J149.817G
물성
구조 계산 물성
- XLogP
- 4.5
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 213
실험 및 물리화학적 성질
PolymersOther Classes -> Polycyclic Aromatic Hydrocarbons
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Vapor Pressure0.0000751 [mmHg]
Physical DescriptionWhite to light yellow crystalline powder; [Alfa Aesar MSDS]
물리화학적 성질
- 녹는점
- 112 · 112-114 °C (lit.)
- 끓는 점
- 185 °C/135 · 185 °C/135 mmHg (lit.)
- 밀도
- 1.4187 · 1.4187 (rough estimate)
- 굴절률
- 1.629 · 1.6290 (estimate)
- 인화점
- 185 °C/135mm · 185°C/135mm
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- 클로로포름과 에틸 아세테이트에 용해됩니다.
- 물리적 상태
- 약간의 결정성 분말 또는 플레이크
- 색상
- 흰색에서 약간 노란색
- BRN
- 1946701 · 1946701
- InChI
- InChI=1S/C13H9Br/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2
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 1.9% (1 of 53) of reports.
Warning
H315 (98.1%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 53 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory InformationStatus: Active Update: 28-09-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/18175
Hazards SummaryAn irritant; [Alfa Aesar MSDS] See POLYCYCLIC AROMATIC HYDROCARBONS.
Hazard Classes and CategoriesSkin Irrit. 2 (98.1%)
안전 데이터
- wgk
- 3
- HS 번호
- 29039990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-37/39
- 위험 등급
- IRRITANT
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도2-Bromofluorene was used in the synthesis of end-capping reagent 2-bromo-9,9-di-nhexylfluorene. It has been used in the preparation of poly(di-n-hexylfluorene)s end capped with 2-bromofluorene, 2-bromo-9,9-di-n-hexylfluorene and 9-bromoanthracene through Ni(0) mediated polymerization. It was also used in the synthesis of 2-bromo-9,9-dihexylfluorene.
일반 설명2-Bromofluorene is a nonintrusive end-capping reagent to control molecular weights and to generate well-defined oligomers. It is used as a reagent for the preparation of dibromofluorene-labelled polystyrene by nitroxide-mediated polymerization. It is also being used in the agricultural sector as a fungicide for tomato disease control. Its carcinogenic effects on humans are currently being investigated.
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