1-(Bromomethyl)-2,3,4-trifluorobenzene

HCID 2777050CAS 157911-55-2

기본 정보

표준 SMILES: Fc1ccc(CBr)c(F)c1F
InChIKey: DGSXDQVPGXFOAN-UHFFFAOYSA-N
분자식: C7H4BrF3
평균 분자량: 225.01 g/mol
단동위원소 질량: 223.94484689

이름 및 식별자

우선 이름: 1-(Bromomethyl)-2,3,4-trifluorobenzene
IUPAC: 1-(bromomethyl)-2,3,4-trifluorobenzene
영어명: 2,3,4-Trifluorobenzyl bromide
분자식: C7H4BrF3
분자량: 225.01

이름 및 동의어

1-(Bromomethyl)-2,3,4-trifluorobenzeneRefChem:427201624-279-92,3,4-Trifluorobenzyl bromide157911-55-2BENZENE, 1-(BROMOMETHYL)-2,3,4-TRIFLUORO-MFCD00061233SCHEMBL489658DTXSID603803502,3,4-Trifluorobenzyl bromide, 97%AKOS015854309PS-9839

이름 더 보기

à-bromo-2,3,4-trifluorotoluene2,3,4-Trifluorobenzylbromide97%2,3,4-Trifluorobenzyl bromide 97%2,3,4-Trifluorobenzyl bromide ISO 9001：2015 REACH

EN300-20063674-(bromomethyl)-1,2,3-trifluorobenzene6-(Bromomethyl)-1,2,3-trifluorobenzeneALPHA-BROMO-2,3,4-TRIFLUOROTOLUENE1-(bromomethyl)-2,3,4-trifluoro-benzeneBC0027982,3,4-TrifluorobenzyA3473

데이터베이스 식별자

CAS: 157911-55-2
PubChem CID: 2777050
DTXSID: DTXSID60380350
EC Number: 624-279-9

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 11
형식 전하: 0
복잡도: 131

물리화학적 성질

끓는 점: 191.4 · 191.4±35.0 °C(Predicted)
밀도: 1.71 g/mL · 1.710 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.5070(lit.)
인화점: 195 °F · 195 °F
저장 조건: 2 · Inert atmosphere,2-8°C
물리적 상태: 액체
색상: 무색~담황색 투명
BRN: 8762822 · 8762822
InChI: InChI=1S/C7H4BrF3/c8-3-4-1-2-5(9)7(11)6(4)10/h1-2H,3H2
InChIKey: DGSXDQVPGXFOAN-UHFFFAOYSA-N
SMILES: C1(CBr)=CC=C(F)C(F)=C1F

화학적 성질

Colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

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

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 5 notifications to the ECHA C&L Inventory.