1-Bromo-4-(methylsulphonyl)benzene (HCID 77014)

이름 및 식별자

우선 이름: 1-Bromo-4-(methylsulphonyl)benzene
IUPAC: 1-bromo-4-methylsulfonylbenzene
영어명: 4-Bromophenyl methyl sulfone
분자식: C7H7BrO2S
분자량: 235.1

이름 및 동의어

4-Bromophenyl methyl sulfone3466-32-8Benzene, 1-bromo-4-(methylsulfonyl)-Methyl 4-bromophenyl sulfonep-Bromophenyl methyl sulfoneSulfone, p-bromophenyl methyl1-Bromo-4-(methylsulphonyl)benzeneNSC 174742EINECS 222-421-0DTXSID20188218RefChem:430602DTXCID50110709

이름 더 보기

4-BromophenylTIMTEC-BB SBB0062944-Bromo phenyl methyl4-BROMOPHENYL METHYL SULFONMethyl 4-Bromophenylsulfone4-Bromophenyl methylesulfoneP-METHYL BENZENESULFOBROMIDEphenylmethanesulfonyl bromide

Benzene, 1-bromo-4-(methylsulfonyl)-(9CI)222-421-0Sulfone, p-bromophenyl methyl (8CI)1-Bromo-4-(methylsulfonyl)benzene1-bromo-4-methylsulfonylbenzene1-bromo-4-methanesulfonylbenzeneMFCD000250654-bromophenyl methyl sulphone

데이터베이스 식별자

CAS: 3466-32-8
PubChem CID: 77014
DTXSID: DTXSID20188218
EC Number: 222-421-0
Nikkaji: J145.971F

물성

구조 계산 물성

XLogP: 1.1
극성 표면적: 42.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 11
형식 전하: 0
복잡도: 209

물리화학적 성질

녹는점: 103 · 103-107 °C (lit.)
끓는 점: 348.6 · 348.6±34.0 °C(Predicted)
밀도: 1.595 · 1.595±0.06 g/cm3(Predicted)
저장 조건: Store at room temperature
용해도: 메탄올에 용해됨
물리적 상태: 결정 또는 결정성 분말
색상: 하얀색
BRN: 2045675 · 2045675
InChI: InChI=1S/C7H7BrO2S/c1-11(9,10)7-4-2-6(8)3-5-7/h2-5H,1H3
InChIKey: FJLFSYRGFJDJMQ-UHFFFAOYSA-N
SMILES: C1(Br)=CC=C(S(C)(=O)=O)C=C1

화학적 성질

Whitetolightyellowcrystalspowe

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): 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 8 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 29309090
risk_code: 22-36/37/38
hazard_code: Xn,Xi
safety_code: 22-24/25-36/37/39-26
위험 참고 사항: Irritant
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 1건

용도4-Bromophenyl methyl sulfone may be used to synthesize:biaryl methyl sulfones5-[[-4-(methylsulfonyl)phenyl]thio]thiophene-2-sulfonamide1-[4-(methylsulfonyl)phenyl]-1H-pyrazole (Hmsppz)DuP 697 via reaction with (5-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl)trimethylsilane4-Bromophenyl methyl sulfone (1-bromo-4-(methylsulfonyl)benzene) can undergo coupling reaction with benzene sulfonamide in the presence of copper(I)iodide to form the corresponding N-aryl sulfonamide.

상·하류 제품 정보

상류 원료

하류 제품

1-브로모-4-(메틸설피닐)벤젠97 1-[4-(메틸술포닐)페닐]피페라진 4-(Methylsulfonyl)phenylhydrazine hydrochloride 1-(4-메탄설포닐-페닐)-피페리딘-4-올 1-(4-(트리플루오로메톡시)페녹시)-4-(메틸설포닐)벤젠 5-[4-(메틸술포닐)페닐]-2H-테트라졸 2-bromo-5-methylsulfonylbenzenesulfonamide

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]

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上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

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연결된 노트

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1-Bromo-4-(methylsulphonyl)benzene

기본 정보