2-OXO-1,2-DIHYDRO-QUINOLINE-3-카르복실산

2-Quinolone-3-carboxylic acid

HCID 332488

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 2003-79-4
표준 SMILES: O=C(O)c1cc2ccccc2[nH]c1=O
InChIKey: XOQQVKDBGLYPGH-UHFFFAOYSA-N
분자식: C10H7NO3
평균 분자량: 189.17 g/mol
단동위원소 질량: 189.04259308

개요

2-Hydroxy-3-quinolinecarboxylic acid has been reported in Penicillium citrinum with data available.

이름 및 식별자

우선 이름: 2-Quinolone-3-carboxylic acid
IUPAC: 2-oxo-1H-quinoline-3-carboxylic acid
현지명: 2-OXO-1,2-DIHYDRO-QUINOLINE-3-카르복실산
영어명: 2-Oxo-1,2-dihydro-quinoline-3-carboxylic acid
분자식: C10H7NO3
분자량: 189.17

이름 및 동의어

2003-79-42-oxo-1,2-dihydroquinoline-3-carboxylic acid3-Quinolinecarboxylic acid, 1,2-dihydro-2-oxo-2-Hydroxy-3-quinolinecarboxylic acid2-quinolone-3-carboxylic acid2-Oxoquinoline-3-carboxylic acid5YC1Y02JDCNSC 329342NSC-329342DTXSID501738543-CARBOXY-2-HYDROXYQUINOLINEQUINOLIN-2(1H)-ONE-3-CARBOXYLIC ACID

이름 더 보기

2-OXO-1,2-DIHYDRO-QUINOLINE-3-카르복실산TIMTEC-BB SBB0102302-Hydroxquinoline-3-carboxylic acid1,2-Dihydro-2-oxoquinoline-3-carboxylic acid2-hydroxyquinoline-3-carboxylic acid(SALTDATA: FREE)

1,2-DIHYDRO-2-OXO-3-QUINOLINECARBOXYLIC ACIDRefChem:483518DTXCID1096345843-452-12-hydroxyquinoline-3-carboxylic acid2-oxo-1H-quinoline-3-carboxylic acid2-Oxo-1,2-dihydro-quinoline-3-carboxylic acid2-oxo-1,2-dihydro-3-quinolinecarboxylic acid

데이터베이스 식별자

CAS: 2003-79-4
PubChem CID: 332488
DTXSID: DTXSID50173854
UNII: 5YC1Y02JDC
EC Number: 843-452-1
Nikkaji: J695.295J

물성

구조 계산 물성

XLogP: 1.6
극성 표면적: 66.4 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 14
형식 전하: 0
복잡도: 308

물리화학적 성질

녹는점: 330 · 330-332°C
끓는 점: 440.9 · 440.9±45.0 °C(Predicted)
밀도: 1.429 · 1.429±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
산도 계수 (pKa): 2.36 · 2.36±0.20(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.