2-Bromo-4-ethylpyridine

HCID 4114248

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 54453-91-7
표준 SMILES: CCc1ccnc(Br)c1
InChIKey: JMDIWBIWPAAWHP-UHFFFAOYSA-N
분자식: C7H8BrN
평균 분자량: 186.05 g/mol
단동위원소 질량: 184.98401

이름 및 식별자

우선 이름: 2-Bromo-4-ethylpyridine
IUPAC: 2-bromo-4-ethylpyridine
영어명: 2-Bromo-4-ethylpyridine
분자식: C7H8BrN
분자량: 186.05

이름 및 동의어

2-Bromo-4-ethylpyridine54453-91-7DTXSID30399459RefChem:257200DTXCID60350316803-831-42-bromo-4-ethyl-pyridine2-Bromo-4-ethyl pyridinePyridine, 2-bromo-4-ethyl-MFCD020942264-Ethyl-2-bromopyridineSCHEMBL648113

이름 더 보기

2-BROMO-4-ETHYLPYRDINE2-Bromo-4-ethylpyridine ISO 9001：2015 REACH

SCHEMBL14157164SCHEMBL20917665SCHEMBL254052372-Bromo-4-ethylpyridine, 96%JMDIWBIWPAAWHP-UHFFFAOYSA-N2-Bromo-4-ethylpyridine, AldrichCPRAKOS006280220AC-5289

데이터베이스 식별자

CAS: 54453-91-7
PubChem CID: 4114248
DTXSID: DTXSID30399459
EC Number: 803-831-4

물성

구조 계산 물성

XLogP: 2.7
극성 표면적: 12.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 85

물리화학적 성질

끓는 점: 68 · 68-70°[email protected] Hg
밀도: 1.425 g/cm3 · 1.425 g/cm3(Temp: 25 °C)
저장 조건: 2 · Sealed in dry,2-8°C
용해도: 에 용해됨클로로포름, 에테르, 에틸아세테이트
물리적 상태: 노란색 액체
산도 계수 (pKa): 1.59 · 1.59±0.10(Predicted)
InChI: 1S/C7H8BrN/c1-2-6-3-4-9-7(8)5-6/h3-5H,2H2,1H3
InChIKey: JMDIWBIWPAAWHP-UHFFFAOYSA-N
SMILES: CCc1ccnc(Br)c1

화학적 성질

Yellow Liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (97.5%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 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.