CAS 14482-51-0 2-Bromo-3,5-dichloropyridine (HCID 817090)

기본 정보

CAS: 14482-51-0
표준 SMILES: Clc1cnc(Br)c(Cl)c1
InChIKey: QCKPJWDIDCGQRB-UHFFFAOYSA-N
분자식: C5H2BrCl2N
평균 분자량: 226.88 g/mol
단동위원소 질량: 224.87476652

이름 및 식별자

우선 이름: 2-Bromo-3,5-dichloropyridine
IUPAC: 2-bromo-3,5-dichloropyridine
영어명: 2-Bromo-3,5-dichloropyridine
분자식: C5H2BrCl2N
분자량: 226.89

이름 및 동의어

2-Bromo-3,5-dichloropyridine14482-51-0DTXSID90355733RefChem:256997DTXCID60306792672-535-33,5-Dichloro-2-BromopyridinePyridine, 2-bromo-3,5-dichloro-MFCD002339902-Bromo-3,5-dichloro-pyridine2-bromo-3,5-dichloropyridinSCHEMBL544483

이름 더 보기

2-Bromo-3,5-dichLAKOS BBS-000013655-Dichloro-2-broMopyridine2-BROMO-3,5-DICHLOROPYRIDUNE2-Bromo-3,5-dichloropyridine >3,5-DICHLORO-2-BROMOPYRIDINE 98+%3,5-DICHLOROPYRIDIN-2-YL-BORONIC ACID

SCHEMBL30023642RB1046SBB039005AKOS000267456AB05062AC-9472CS-W007790GS-6730

데이터베이스 식별자

CAS: 14482-51-0
PubChem CID: 817090
DTXSID: DTXSID90355733
EC Number: 672-535-3
Nikkaji: J38.528J

물성

구조 계산 물성

XLogP: 3.2
극성 표면적: 12.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 9
형식 전하: 0
복잡도: 101

물리화학적 성질

녹는점: 40 · 40-42
끓는 점: 243.3 · 243.3±35.0 °C(Predicted)
밀도: 1.848 · 1.848±0.06 g/cm3(Predicted)
저장 조건: Inert atmosphere,Room Temperature
산도 계수 (pKa): -2.37 · -2.37±0.10(Predicted)
물리적 상태: 고체
색상: 옅은 갈색
InChI: InChI=1S/C5H2BrCl2N/c6-5-4(8)1-3(7)2-9-5/h1-2H
InChIKey: QCKPJWDIDCGQRB-UHFFFAOYSA-N
SMILES: C1(Br)=NC=C(Cl)C=C1Cl

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]

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 4 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. 4 (25%)

안전 데이터

wgk: WGK 3
HS 번호: 2933399990
risk_code: 36/37/38-41-37/38-25
hazard_code: Xi,T
safety_code: 26-45-39
위험 등급: 6.1
기존화학 물질: KE-03649
위험 참고 사항: Irritant
Hazard Classifications: Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

응용 분야 · 1건

용도2-Bromo-3,5-dichloropyridine is used in various fields, including pharmaceuticals, agrochemicals, and materials science. It is an essential intermediate for the synthesis of different chemical compounds, such as fungicides, herbicides, and insecticides.