3-Chloro-2-fluoro-5-(trifluoromethyl)pyridine

HCID 1268075

노트 반응

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기본 정보

CAS: 72537-17-8
표준 SMILES: Fc1ncc(C(F)(F)F)cc1Cl
InChIKey: GDSROTVTTLUHCO-UHFFFAOYSA-N
분자식: C6H2ClF4N
평균 분자량: 199.53 g/mol
단동위원소 질량: 198.98118962

이름 및 식별자

우선 이름: 3-Chloro-2-fluoro-5-(trifluoromethyl)pyridine
IUPAC: 3-chloro-2-fluoro-5-(trifluoromethyl)pyridine
영어명: 3-CHLORO-2-FLUORO-5-(TRIFLUOROMETHYL)PYRIDINE
분자식: C6H2ClF4N
분자량: 199.53

이름 및 동의어

3-Chloro-2-fluoro-5-(trifluoromethyl)pyridine72537-17-8DTXSID40361445RefChem:278154DTXCID60312494625-955-6MFCD00191918Pyridine, 3-chloro-2-fluoro-5-(trifluoromethyl)-3-chloro-2-fluoro-5-trifluoromethylpyridineSCHEMBL805963SCHEMBL30285317SBB054395

이름 더 보기

2-FLUORO-3-CHLORO-5-(TRIFLUOROMETHYL)PYRIDINECHLORO-2-FLUORO-5-(TRIFLUOROMETHYL)PYRIDINE3-Chloro-2-fluoro-5-(trifluoromethyl)pyridine >3-Chloro-2-fluoro-5-(trifluoromethyl)pyridine 98%2-Fluoro-3-chloro-5-(trifluoromethyl)pyridine (co-product)TIANFU-CHEM 3-CHLORO-2-FLUORO-5-(TRIFLUOROMETHYL)PYRIDINE3-CHLORO-2-FLUORO-5-(TRIFLUOROMETHYL)PYRIDINE ISO 9001：2015 REACH

AKOS006221193AB04634CS-W010502FS-4057AC-23340BP-12792SY033483DB-055650

데이터베이스 식별자

CAS: 72537-17-8
PubChem CID: 1268075
DTXSID: DTXSID40361445
EC Number: 625-955-6
Nikkaji: J2.071.196E

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 12.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 5
회전 가능 결합 수: 0
무거운 원자 수: 12
형식 전하: 0
복잡도: 160

물리화학적 성질

녹는점: 16 · 16-20 °C (lit.)
끓는 점: 50 · 50-55 °C/11 mmHg (lit.)
밀도: 1.524 g/mL · 1.524 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.433(lit.)
인화점: 125 °F · 125 °F
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: 액체
색상: 무색의
InChI: InChI=1S/C6H2ClF4N/c7-4-1-3(6(9,10)11)2-12-5(4)8/h1-2H
InChIKey: GDSROTVTTLUHCO-UHFFFAOYSA-N
SMILES: C1(F)=NC=C(C(F)(F)F)C=C1Cl

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

안전 데이터

wgk: 3
ridadr: UN 1993 3/PG 3
HS 번호: 29333990
risk_code: 10-36/37/38
hazard_code: Xi
safety_code: 26-36
포장분류: III
위험 등급: 3.2
위험 참고 사항: Irritant
Hazard Classifications: Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

응용 분야

일반 설명3-Chloro-2-fluoro-5-(trifluoromethyl)pyridine, a halogenated pyridine derivative, is a fluorinated building block. It participates in the synthesis of 2,3-difluoro-5-(trifluoromethyl)pyridine.