2-하이드록시-9-FLUORENONE

2-Hydroxyfluoren-9-one

HCID 81386CAS 6949-73-1

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=C1c2ccccc2-c2ccc(O)cc21
InChIKey: GXUBPHMYNSICJC-UHFFFAOYSA-N
분자식: C13H8O2
평균 분자량: 196.2 g/mol
단동위원소 질량: 196.0524295

이름 및 식별자

우선 이름: 2-Hydroxyfluoren-9-one
IUPAC: 2-hydroxyfluoren-9-one
현지명: 2-하이드록시-9-FLUORENONE
영어명: 2-Hydroxy-9-fluorenone
분자식: C13H8O2
분자량: 196.2

이름 및 동의어

2-Hydroxyfluoren-9-oneNSC 22835DTXSID00219716EINECS 230-119-5RefChem:473452DTXCID50142207230-119-52-Hydroxy-9H-fluoren-9-one6949-73-1MFCD00001155DR37FXR63QNSC22835

이름 더 보기

2-하이드록시-9-FLUORENONE2-Hydroxyfluorenone.2-Hydroxy-9-fluorenone2-Hydroxy-9-fluorenone>2-Hydroxy-9-fluorenone,97%2-Hydroxy-9-fluorenone in toluene2-[(3-chloroanilino)methylidene]propanedinitrile

2-hydroxy-fluoren-9-oneNSC-228352-Hydroxy-9-fluorenone, 98%9H-Fluoren-9-one, 2-hydroxy-CS-W010597AS-58713H0329Z1255485150

데이터베이스 식별자

CAS: 6949-73-1
PubChem CID: 81386
DTXSID: DTXSID00219716
ChEMBL: CHEMBL1998832
UNII: DR37FXR63Q
EC Number: 230-119-5
Nikkaji: J208.569K

물성

구조 계산 물성

XLogP: 3.3
극성 표면적: 37.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 15
형식 전하: 0
복잡도: 274

실험 및 물리화학적 성질

Endocrine DisruptorsPotential endocrine disrupting compound

물리화학적 성질

녹는점: 204 · 204-206 °C(lit.)
끓는 점: 293.09 °C · 293.09°C (rough estimate)
밀도: 1.1482 · 1.1482 (rough estimate)
굴절률: 1.5954 · 1.5954 (estimate)
저장 조건: Sealed in dry,Room Temperature
용해도: 아세톤에 용해됨
산도 계수 (pKa): 9.09 · 9.09±0.20(Predicted)
물리적 상태: 가루
색상: 노란색에서 주황색으로

화학적 성질

pink-red to red-brown powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
HS 번호: 29145090
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-37/39

화학 및 산업

응용 분야 · 1건

용도Reactant involved in:One-pot synthesis of aryl substituted auronesStudies to tune HOMO-LUMO levels of 9-fluorenone scaffoldsO-methylation for synthesis of second-generation light driven rotary molecular motorsReactions with aluminum, gallium compounds, and methylquinolinesSynthesis of acridinyl- and fluorenylidenehydrazido calixarenesAcetylation for synthesis of acetates