CAS 23779-96-6 8-(Trifluoromethyl)quinolin-4-ol (HCID 178516442)

기본 정보

CAS: 23779-96-6
표준 SMILES: Oc1ccnc2c(C(F)(F)F)cccc12
InChIKey: UDRWADJLLWWJOE-UHFFFAOYSA-N
분자식: C10H6F3NO
평균 분자량: 213.16 g/mol
단동위원소 질량: 213.0401483

이름 및 식별자

우선 이름: 8-(Trifluoromethyl)quinolin-4-ol
IUPAC: 8-(trifluoromethyl)-1H-quinolin-4-one
현지명: 4-히드록시-8-(트리플루오로메틸)퀴놀린
영어명: 8-(TRIFLUOROMETHYL)QUINOLIN-4-OL
분자식: C10H6F3NO
분자량: 213.16

이름 및 동의어

23779-96-68-(Trifluoromethyl)quinolin-4-ol8-(trifluoromethyl)-4-quinolinolEINECS 245-879-3DTXSID90917113RefChem:547530DTXCID601346073245-879-34-Hydroxy-8-(trifluoromethyl)quinoline93919-57-48-(Trifluoromethyl)quinolin-4(1H)-one8-(trifluoromethyl)-1H-quinolin-4-one

이름 더 보기

4-히드록시-8-(트리플루오로메틸)퀴놀린BUTTPARK 13\01-634-Quinolinol, 8-(trifluoromethyl)-4-hydroxy-8-(trfluoroMethyl)quinoline8-(TRIFLUOROMETHYL)QUINOLIN-4-OL ISO 9001：2015 REACH

MFCD001345774-hydroxy-8-trifluoromethylquinolineSCHEMBL1091417F0919-0892SB68654SY0035818-trifluoromethyl-4-quinolinol8-Trifluoromethyl-quinolin-4-ol

데이터베이스 식별자

CAS: 23779-96-6、93919-57-4
PubChem CID: 90261

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 29.1 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 0
무거운 원자 수: 15
형식 전하: 0
복잡도: 298

물리화학적 성질

녹는점: 174 · 174-176 °C(lit.)
끓는 점: 311.9 · 311.9±37.0 °C(Predicted)
밀도: 1.433 · 1.433±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
물리적 상태: powder to crystal
산도 계수 (pKa): 3.51 · 3.51±0.40(Predicted)
색상: White to Light gray to Light yellow

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 5 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.