8-Hydroxy-2-quinolinecarboxaldehyde

HCID 599342CAS 14510-06-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=Cc1ccc2cccc(O)c2n1
InChIKey: SLBPIHCMXPQAIQ-UHFFFAOYSA-N
분자식: C10H7NO2
평균 분자량: 173.17 g/mol
단동위원소 질량: 173.04767846

개요

8-hydroxyquinoline-2-carbaldehyde is a hydroxyquinoline.

이름 및 식별자

우선 이름: 8-Hydroxy-2-quinolinecarboxaldehyde
IUPAC: 8-hydroxyquinoline-2-carbaldehyde
영어명: 8-Hydroxyquinoline-2-carboxaldehyde
분자식: C10H7NO2
분자량: 173.17

이름 및 동의어

8-Hydroxy-2-quinolinecarboxaldehydeRefChem:548135627-898-28-hydroxyquinoline-2-carbaldehyde14510-06-68-Hydroxyquinoline-2-carboxaldehyde2-Quinolinecarboxaldehyde, 8-hydroxy-MFCD001689628-oxidanylquinoline-2-carbaldehyde2-formyl-8-hydroxyquinoline8-HYDROXY-QUINOLINE-2-CARBALDEHYDEDTXSID20344771

이름 더 보기

AKOS BBS-000001288-hydroxyquinaldaldehydeQuinaldaldehyde, 8-hydroxy-8-HYDROXYQUINOLINE-2-CARBOXALDEHYDE 98%8-Hydroxyquinoline-2-carboxaldehyde ,98%

CS-W017556H1713EN300-822178MJ8-Hydroxy-2-quinolinecarbaldehydeA808320Oprea1_030534Oprea1_135969

데이터베이스 식별자

CAS: 14510-06-6
PubChem CID: 599342
DTXSID: DTXSID20344771
ChEMBL: CHEMBL2321986
ChEBI: CHEBI:183895
EC Number: 627-898-2
Nikkaji: J102.443D

물성

구조 계산 물성

XLogP: 1.6
극성 표면적: 50.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 195

물리화학적 성질

녹는점: 97 · 97-100 °C
끓는 점: 392.2 · 392.2±22.0 °C(Predicted)
밀도: 1.364 · 1.364±0.06 g/cm3(Predicted)
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
산도 계수 (pKa): 9.27 · 9.27±0.10(Predicted)
물리적 상태: 결정성 분말
색상: 노란색
BRN: 127519 · 127519
InChI: InChI=1S/C10H7NO2/c12-6-8-5-4-7-2-1-3-9(13)10(7)11-8/h1-6,13H
InChIKey: SLBPIHCMXPQAIQ-UHFFFAOYSA-N
SMILES: N1C2C(=CC=CC=2O)C=CC=1C=O

화학적 성질

yellow crystalline 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 42 reports by companies from 5 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: 29339900
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36-37/39
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

응용 분야 · 2건

용도8-Hydroxy-2-quinolinecarboxaldehyde (8-hydroxyquinoline-2-carbaldehyde) may be used in the preparation of:8-hydroxy-2-quinoline-1-aminopyrene by Schiff-base reaction with 1-aminopyrene(E)-2-((2-(pyridin-2-yl)hydrazono)methyl)quinolin-8-ol by coupling with 2-hydrazinopyridine8-hydroxyquinoline-2-carbaldehyde oxime2-[(8-Hydroxyquinoline)-2-methylaminoethyl]-β-D-glucopyranoside

일반 설명8-Hydroxy-2-quinolinecarboxaldehyde can be prepared from 2-methylquinolin-8-ol via oxidation using selenium dioxide.