2-Bromo-1,4-dichlorobenzene

HCID 15033CAS 1435-50-3

기본 정보

표준 SMILES: Clc1ccc(Cl)c(Br)c1
InChIKey: OVXVQBCRONSPDC-UHFFFAOYSA-N
분자식: C6H3BrCl2
평균 분자량: 225.89 g/mol
단동위원소 질량: 223.87952

이름 및 식별자

우선 이름: 2-Bromo-1,4-dichlorobenzene
IUPAC: 2-bromo-1,4-dichlorobenzene
영어명: 2-Bromo-1,4-dichlorobenzene
분자식: C6H3BrCl2
분자량: 225.9

이름 및 동의어

2-BROMO-1,4-DICHLOROBENZENE1435-50-3RefChem:1062420215-859-91-Bromo-2,5-dichlorobenzeneBenzene, 2-bromo-1,4-dichloro-2,5-dichlorobromobenzene2-bromo-1,4-dichloro-benzeneMFCD00018505Benzene, 1-bromo-2,5-dichloro-2-Bromo-1,4-dichlorobenzene, 97%AKOS000121086

이름 더 보기

2-Bromo-1,4-dichloro2,5-Dichlorobeomobenzene2,5-Dichlorophenyl bromide1-Bromo-2,5-dichlorobenzene,99%1-Bromo-2,5-dichlorobenzene >

B09812,5-Dichlorobromobenzene 1-Bromo-2,5-dichlorobenzeneEINECS 215-859-9FT-0611365A8080862,5-dichloro-1-bromobenzeneSCHEMBL458721SCHEMBL504938

데이터베이스 식별자

CAS: 1435-50-3、68583-99-3
PubChem CID: 15033
DTXSID: DTXSID7075185
EC Number: 215-859-9
Nikkaji: J31.737C

물성

구조 계산 물성

XLogP: 4.1
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 97

물리화학적 성질

녹는점: 32 · 32-36 °C(lit.)
끓는 점: 118 · 118-120°C 20mm
밀도: 1.6351 · 1.6351 (rough estimate)
굴절률: 1.57 · 1.5700 (estimate)
인화점: 230 °F · >230 °F
저장 조건: Sealed in dry,Room Temperature
물리적 상태: powder to lump to clear liquid
색상: White or Colorless to Light orange to Yellow
수용성: 불용성
BRN: 1934815 · 1934815
InChI: InChI=1S/C6H3BrCl2/c7-5-3-4(8)1-2-6(5)9/h1-3H
InChIKey: OVXVQBCRONSPDC-UHFFFAOYSA-N
SMILES: C1(Cl)=CC=C(Cl)C=C1Br
NIST: 2 · Benzene, 2-bromo-1,4-dichloro-(1435-50-3)
EPA: 2 · Benzene, 2-bromo-1,4-dichloro- (1435-50-3)

화학적 성질

white to light yellow crystal powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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.