5-브로모-2-클로로-3-플루오로피리딘

5-Bromo-2-chloro-3-fluoropyridine

HCID 2763285CAS 831203-13-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Fc1cc(Br)cnc1Cl
InChIKey: OEKXUEWGXWCENG-UHFFFAOYSA-N
분자식: C5H2BrClFN
평균 분자량: 210.43 g/mol
단동위원소 질량: 208.90432

이름 및 식별자

우선 이름: 5-Bromo-2-chloro-3-fluoropyridine
IUPAC: 5-bromo-2-chloro-3-fluoropyridine
현지명: 5-브로모-2-클로로-3-플루오로피리딘
영어명: 5-Bromo-2-chloro-3-fluoropyridine
분자식: C5H2BrClFN
분자량: 210.43

이름 및 동의어

5-Bromo-2-chloro-3-fluoropyridine831203-13-5DTXSID80376871RefChem:102111DTXCID90327899672-941-05-BROMO-2-CHLORO-3-FLUORO-PYRIDINEC5H2BrClFNMFCD03411574Pyridine, 5-bromo-2-chloro-3-fluoro-CS-D0950AB14161

이름 더 보기

5-브로모-2-클로로-3-플루오로피리딘7-aminonicotinic acid5-Bromo-2-chloro-3-fluoropyridin3-BroMo-6-chloro-5-fluoropyridine5-Bromo-2-chloro-3-fluoropylidinePyridine,5-broMo-2-chloro-3-fluoro-2 - chloro 5 - bromo 3 - fluoro pyridine5-Bromo-2-chloro-3-fluoropyridine ISO 9001：2015 REACH

AC-4377GS-69045-Bromo-2-chloro-3-fluoropyridine, AldrichCPRA1-534132-CHLORO-3-FLUORO-5-BROMOPYRIDINEN-Benzylbenzo[d]isothiazolSCHEMBL16392OEKXUEWGXWCENG-UHFFFAOYSA-N

데이터베이스 식별자

CAS: 831203-13-5
PubChem CID: 2763285
DTXSID: DTXSID80376871
EC Number: 672-941-0

물성

구조 계산 물성

XLogP: 2.6
극성 표면적: 12.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 103

물리화학적 성질

녹는점: 50 · 50-52℃
끓는 점: 195.3 · 195.3±35.0 °C(Predicted)
밀도: 1.829 · 1.829±0.06 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
산도 계수 (pKa): -2.44 · -2.44±0.10(Predicted)
물리적 상태: 고체
색상: 하얀색

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (42.9%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (14.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (85.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (85.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (14.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (71.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, 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 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (42.9%)；Skin Irrit. 2 (85.7%)；Eye Irrit. 2 (85.7%)；STOT SE 3 (71.4%)

안전 데이터

HS 번호: 2933399990
risk_code: 22-37/38-41
hazard_code: Xi,Xn
safety_code: 26-39
위험 등급: IRRITANT

화학 및 산업

응용 분야

용도5-Bromo-2-chloro-3-fluoropyridine is an important organic chemical with a high reactivity that can be used in chemoselective amination reactions. It is also used as a pharmaceutical intermediate.