1-Bromo-2-(bromomethyl)-4-(trifluoromethyl)benzene

HCID 2756249CAS 875664-32-7

기본 정보

표준 SMILES: FC(F)(F)c1ccc(Br)c(CBr)c1
InChIKey: TXJHPBWTPBYLFP-UHFFFAOYSA-N
분자식: C8H5Br2F3
평균 분자량: 317.93 g/mol

이름 및 식별자

우선 이름: 1-Bromo-2-(bromomethyl)-4-(trifluoromethyl)benzene
IUPAC: 1-bromo-2-(bromomethyl)-4-(trifluoromethyl)benzene
영어명: 2-Bromo-5-(trifluoromethyl)benzyl bromide
분자식: C8H5Br2F3
분자량: 317.93

이름 및 동의어

886496-63-51-bromo-2-(bromomethyl)-4-(trifluoromethyl)benzeneRefChem:430218805-502-02-Bromo-5-(trifluoromethyl)benzyl bromide875664-32-72-bromo-5-trifluoromethylbenzyl bromideMFCD049737622-BROMO-5-TRIFLUOROMETHYL-BENZYLBROMIDE1-Bromo-2-(bromomethyl)-4-(1,1-dimethylethyl)-benzeneSCHEMBL475304SCHEMBL29382636

이름 더 보기

Benzene, 1-bromo-2-(bromomethyl)-4-(trifluoromethyl)-

AKOS005258010AS-35491DA-29700DB-024320EN300-3102901F0137921-Bromo-2-(bromomethyl)-4-(trifluoromethyl)benzene, 4-Bromo-3-(bromomethyl)benzotrifluoride

데이터베이스 식별자

CAS: 875664-32-7、886496-63-5
PubChem CID: 2756249
EC Number: 642-533-7、805-502-0

물성

구조 계산 물성

XLogP: 4.1
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 169

물리화학적 성질

끓는 점: 259 ℃ · 259℃
밀도: 1.885 · 1.885
인화점: 110 ℃ · 110℃
물리적 상태: 액체
색상: Clear, colourless

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P337+P317, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]