1,3-Dichloro-2-fluoro-5-nitrobenzene

HCID 76554CAS 3107-19-5

기본 정보

표준 SMILES: O=[N+]([O-])c1cc(Cl)c(F)c(Cl)c1
InChIKey: VMAATSFMXSMKPG-UHFFFAOYSA-N
분자식: C6H2Cl2FNO2
평균 분자량: 209.99 g/mol
단동위원소 질량: 208.94466188

이름 및 식별자

우선 이름: 1,3-Dichloro-2-fluoro-5-nitrobenzene
IUPAC: 1,3-dichloro-2-fluoro-5-nitrobenzene
영어명: 3,5-Dichloro-4-fluoronitrobenzene
분자식: C6H2Cl2FNO2
분자량: 209.99

이름 및 동의어

3107-19-51,3-Dichloro-2-fluoro-5-nitrobenzeneEINECS 221-466-3DTXSID00185023RefChem:72617DTXCID10107514221-466-33,5-Dichloro-4-fluoronitrobenzeneBenzene, 1,3-dichloro-2-fluoro-5-nitro-MFCD001299631,3-Dichloro-2-fluoro-5-nitro-benzene7GS7VN6LFA

이름 더 보기

uoro-1-nitrob3,5-Dichloro-4-fluoro-1-nitrob5-Dichloro-4-fluoronitrobenzene2,6-DICHLORO-P-NITROFLUOROBENZENE3,5 dichloro 4-Fluoro Nirto Benzene3,5-Dichloro-4-fluoronitrobenzene99%

3,5-Dichloro-4-fluoro-1-nitrobenzeneUNII-7GS7VN6LFA2,6-DICHLORO-4-NITROFLUOROBENZENESCHEMBL14244404-Fluoro-3,5-dichloronitrobenzeneSBB063090AKOS015888138AC-9706

데이터베이스 식별자

CAS: 3107-19-5
PubChem CID: 76554
DTXSID: DTXSID00185023
UNII: 7GS7VN6LFA
EC Number: 221-466-3
Nikkaji: J133.173F

물성

구조 계산 물성

XLogP: 3.4
극성 표면적: 45.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 12
형식 전하: 0
복잡도: 175

물리화학적 성질

녹는점: 44 °C · 44 °C
끓는 점: 259.3 · 259.3±35.0 °C(Predicted)
밀도: 1.622 · 1.622±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
물리적 상태: 가루
색상: 하얀색

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationStatus: Active Update: 31-03-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/34697

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

HS 번호: 2904990090
hazard_code: Xi
위험 참고 사항: Irritant

화학 및 산업

응용 분야

용도3,5-Dichloro-4-fluoronitrobenzene is an important synthetic chemical raw material for the synthesis of other compounds. It is commonly used in chemical factories and laboratory research.

제조 방법 · 1건

3,5-Dichloro-4-fluoronitrobenzene can be produced by reacting persulfate with ammonium nitrate to form a phosphine salt. The phosphine salt reacts with 3,5-Dichloro-4-fluorobenzene in the presence of hydrogen peroxide to form the desired product. The reaction occurs on a large scale to produce 3,5-dichloro-4-fluoronitrobenzene in high yield.