2-클로로-4-FLUOROIODOBENZENE

2-Chloro-4-fluoro-1-iodobenzene

HCID 2736559CAS 101335-11-9

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Fc1ccc(I)c(Cl)c1
InChIKey: POTCKVPDYXEGSV-UHFFFAOYSA-N
분자식: C6H3ClFI
평균 분자량: 256.44 g/mol
단동위원소 질량: 255.895204

이름 및 식별자

우선 이름: 2-Chloro-4-fluoro-1-iodobenzene
IUPAC: 2-chloro-4-fluoro-1-iodobenzene
현지명: 2-클로로-4-FLUOROIODOBENZENE
영어명: 2-Chloro-4-fluoroiodobenzene
분자식: C6H3ClFI
분자량: 256.44

이름 및 동의어

2-chloro-4-fluoro-1-iodobenzene101335-11-92-Chloro-4-fluoroiodobenzeneDTXSID20371441RefChem:468961DTXCID40322475600-191-61-Chloro-5-fluoro-2-iodobenzenebenzene, 2-chloro-4-fluoro-1-iodo-2-chloro-4-fluoro-1-iodo-benzeneMFCD000517742-Chloro-4-fluoro-iodobenzene

이름 더 보기

2-클로로-4-FLUOROIODOBENZENEcolorless liquid2-Chloro-4-fluoroiodo3-Chloro-4-iodofluorobenzene4-Fluoro-2-chloroiodobenzene3-Chloro-1-fluoro-4-iodobenzene2-Chloro-4-fluoroiodobenzene98%2-Chloro-4-fluoroiodobenzene 98%Benzene,2-chloro-4-fluoro-1-iodo-

SCHEMBL2303874-fluoro-2-chloro-iodoben4-fluoro-2-chloro-iodobenzeneSCHEMBL295178372-Chloro-4-fluoro-1-iodobenzolSBB101765AKOS005259729CS-W008327

데이터베이스 식별자

CAS: 101335-11-9
PubChem CID: 2736559
DTXSID: DTXSID20371441
EC Number: 600-191-6、923-932-8

물성

구조 계산 물성

XLogP: 3.3
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 99.1

물리화학적 성질

끓는 점: 96 °C · 96 °C
밀도: 2.008 · 2.008±0.06 g/cm3(Predicted)
굴절률: 1.601 · 1.601
인화점: 96 · 96-98°C/15mm
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
물리적 상태: 액체
색상: Clear, colourless
BRN: 2435080 · 2435080
InChI: 1S/C6H3ClFI/c7-5-3-4(8)1-2-6(5)9/h1-3H
InChIKey: POTCKVPDYXEGSV-UHFFFAOYSA-N
SMILES: Fc1ccc(I)c(Cl)c1

화학적 성질

Clear colourless to light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (14.3%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (14.3%)

안전 데이터

wgk: WGK 3
HS 번호: 2903998090
risk_code: 36/37/38-22-36
hazard_code: Xi,Xn
safety_code: 26-36/37/39-23
위험 등급: IRRITANT
Hazard Classifications: Acute Tox. 3 OralEye Irrit. 2
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

응용 분야 · 1건

용도2-Chloro-4-fluoroiodobenzene is a polyhalogenated benzene derivative containing reactive substituents such as fluorine, bromine and iodine atoms in its structure. It can be used as a raw material for the preparation of organic synthesis for the preparation of other organic heterocyclic compounds. It can also be used as a key intermediate component in the manufacture of pharmaceuticals.