4-브로모벤조트리플루오르화물

Benzene, 1-bromo-4-(trifluoromethyl)-

HCID 67872
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기본 정보

CAS
402-43-7
표준 SMILES
FC(F)(F)c1ccc(Br)cc1
InChIKey
XLQSXGGDTHANLN-UHFFFAOYSA-N
분자식
C7H4BrF3
평균 분자량
225.01 g/mol
단동위원소 질량
223.94484689

이름 및 식별자

우선 이름
Benzene, 1-bromo-4-(trifluoromethyl)-
IUPAC
1-bromo-4-(trifluoromethyl)benzene
현지명
4-브로모벤조트리플루오르화물
영어명
4-Bromobenzotrifluoride
분자식
C7H4BrF3
분자량
225.01

이름 및 동의어

4-Bromobenzotrifluoride1-Bromo-4-(trifluoromethyl)benzeneBenzene, 1-bromo-4-(trifluoromethyl)-EINECS 206-943-6DTXSID0059950RefChem:562420DTXCID9039731Benzene, 1bromo4(trifluoromethyl)4Bromoalpha,alpha,alphatrifluorotoluene402-43-7p-Bromobenzotrifluoride4-Bromo-alpha,alpha,alpha-trifluorotoluene
이름 더 보기
4-브로모벤조트라이플루오라이드4-브로모벤조트리플루오르화물4-BromobenzotrifL4-Bromobenzotrifluor4-bormobenzotrifluorideP-BROMOTRIFLUOROTOLUENE4-BROMOTRIFLUOROTOLUENE4-BroMobenzotrifluroride4/p-Bromobenzotrifluoride
MFCD000003981-Bromo-4-trifluoromethylbenzene4-Trifluoromethylbromobenzenep-(Trifluoromethyl)bromobenzeneToluene, p-bromo-.alpha.,.alpha.,.alpha.-trifluoro-4-bromo-1-(trifluoromethyl)benzene4-bromo-trifluoromethylbenzene4-trifluoromethylphenyl bromide

데이터베이스 식별자

CAS
402-43-7
PubChem CID
67872
DTXSID
DTXSID0059950
UNII
Q96KAT73BD
EC Number
206-943-6
Nikkaji
J208.126A

물성

구조 계산 물성

XLogP
3.9
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
0
무거운 원자 수
11

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Halogenated Monoaromatics
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physical DescriptionColorless liquid with an aromatic odor; [Alfa Aesar MSDS]

물리화학적 성질

끓는 점
154 · 154-155 °C(lit.)
밀도
1.607 g/mL · 1.607 g/mL at 25 °C(lit.)
굴절률
20 · n20/D 1.472(lit.)
인화점
120 °F · 120 °F
저장 조건
Sealed in dry,Room Temperature
용해도
어렵거나 섞일 수 없음

화학적 성질

CLEAR COLOURLESS TO LIGHT YELLOW LIQUID

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 52 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 23-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33388

4-Bromobenzotrifluoride: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryA skin and strong eye irritant; [Alfa Aesar MSDS]
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
CSL Reaction Information · 6건

CSL00133

MAGNESIUM + 4-BROMOBENZOTRIFLUORIDE + DIETHYL ETHER

Explosion hazard

Explosive

Grignard

http://pubs.acs.org/cen/safety/19970317.html

안전 데이터

wgk
3
tsca
TSCA listed
ridadr
UN 1993 3/PG 3
HS 번호
29036990
risk_code
10-36/37/38
hazard_code
Xi,F,Xn

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzene, 1-bromo-4-(trifluoromethyl)-: ACTIVE

응용 분야

용도4-Bromobenzotrifluoride is used to study the catalytic activity of palladacycle using Suzuki-Miyaura reaction.

상·하류 제품 정보

공급사100 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]

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