8-브로모-4-클로로-2-메틸퀴놀린

8-Bromo-4-chloro-2-methylquinoline

HCID 768483CAS 1201-07-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cc1cc(Cl)c2cccc(Br)c2n1
InChIKey: SDVHWORPDUOWDV-UHFFFAOYSA-N
분자식: C10H7BrClN
평균 분자량: 256.52 g/mol
단동위원소 질량: 254.94504

이름 및 식별자

우선 이름: 8-Bromo-4-chloro-2-methylquinoline
IUPAC: 8-bromo-4-chloro-2-methylquinoline
현지명: 8-브로모-4-클로로-2-메틸퀴놀린
영어명: 8-BROMO-4-CHLORO-2-METHYLQUINOLINE
분자식: C10H7BrClN
분자량: 256.53

이름 및 동의어

8-Bromo-4-chloro-2-methylquinoline1201-07-6DTXSID20354310RefChem:311831DTXCID50305370802-663-9Quinoline, 8-bromo-4-chloro-2-methyl-MFCD002724322-methyl-4-chloro-8-bromo-quinolineSCHEMBL317207AKOS000618523AB05684

이름 더 보기

8-브로모-4-클로로-2-메틸퀴놀린8-BROMO-4-CHLOROQUINALDINE2-Methyl-4-chloro-8-BroMoquinoline

AC-37177BS-14541C71676EN300-627350AN-584/133692248-Bromo-4-chloro-2-methyl-quinoline8-Bromo-4-chloro-2-methylquinWLZ4059

데이터베이스 식별자

CAS: 1201-07-6
PubChem CID: 768483
DTXSID: DTXSID20354310
EC Number: 802-663-9

물성

구조 계산 물성

XLogP: 3.9
극성 표면적: 12.9 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 13
형식 전하: 0
복잡도: 188

물리화학적 성질

끓는 점: 321.9 · 321.9±37.0 °C(Predicted)
밀도: 1.591 · 1.591±0.06 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: 가루
산도 계수 (pKa): 1.71 · 1.71±0.50(Predicted)
색상: 연한 갈색
InChI: 1S/C10H7BrClN/c1-6-5-9(12)7-3-2-4-8(11)10(7)13-6/h2-5H,1H3
InChIKey: SDVHWORPDUOWDV-UHFFFAOYSA-N
SMILES: Cc1cc(Cl)c2cccc(Br)c2n1

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 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. 3 (100%)；Eye Dam. 1 (100%)

안전 데이터

wgk: 3
ridadr: UN 2811 6.1 / PGIII
HS 번호: 2933499090
risk_code: 25-41
hazard_code: T
safety_code: 26-39-45
Hazard Classifications: Acute Tox. 3 OralEye Dam. 1
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects