1-Cyclopropyl-6,7-difluoro-8-hydroxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

HCID 11680737CAS 154093-72-8

기본 정보

표준 SMILES: O=C(O)c1cn(C2CC2)c2c(O)c(F)c(F)cc2c1=O
InChIKey: NTWOKQCCNHKEIU-UHFFFAOYSA-N
분자식: C13H9F2NO4
평균 분자량: 281.21 g/mol
단동위원소 질량: 281.04996421

이름 및 식별자

우선 이름: 1-Cyclopropyl-6,7-difluoro-8-hydroxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
IUPAC: 1-cyclopropyl-6,7-difluoro-8-hydroxy-4-oxoquinoline-3-carboxylic acid
영어명: 1-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-hydroxy-4-oxo-3-quinolinecarboxylic Acid
분자식: C13H9F2NO4
분자량: 281.21

이름 및 동의어

154093-72-81-Cyclopropyl-6,7-difluoro-8-hydroxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid1-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-hydroxy-4-oxo-3-quinolinecarboxylic AcidYQE3ANK2UIDifluorohydroxy compound [USP]DTXSID50470532DIFLUOROHYDROXY COMPOUND [USP IMPURITY]3-Quinolinecarboxylic acid, 1-cyclopropyl-6,7-difluoro-1,4-dihydro-8-hydroxy-4-oxo-Difluorohydroxy compound (USP)DIFLUOROHYDROXY COMPOUND (USP IMPURITY)RefChem:431951DTXCID80421350

이름 더 보기

Gatifloxacin USP RC BMoxifloxacin Impurity 231-cyclopropyl-6,7-difluoroGatifloxacin USP IMpurity BDifluorohydroxy gatifloxacinGatifloxacin hydroxy acid impurityMoxifloxacin Difluoro Hydroxy ImpurityMoxifloxacin hydroxyquinoline impurities

895-837-9MFCD259735061-cyclopropyl-6,7-difluoro-8-hydroxy-4-oxoquinoline-3-carboxylic acid1-Cyclopropyl-6,7-difluoro-8-hydroxy-4-oxo-1,4-dihydroquinoline-3-carboxylicacidDiketopiperazine; 3-Quinolinecarboxylic acid, 1-cyclopropyl-6,7-difluoro-1,4-dihydro-8-hydroxy-4-oxo-; 1-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-hydroxy-4-oxo-3-quinolinecarboxylic acid; 1-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-hydroxy-4-oxo-3-quinolinecarboxylic Acid (8-Hydroxyquinolonic Acid)Mosisasin Impurity E2UNII-YQE3ANK2UIMoxifloxacin Impurity 81

데이터베이스 식별자

CAS: 154093-72-8
PubChem CID: 11680737
DTXSID: DTXSID50470532
UNII: YQE3ANK2UI
EC Number: 895-837-9

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 77.8 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 7
회전 가능 결합 수: 2
무거운 원자 수: 20
형식 전하: 0
복잡도: 491

물리화학적 성질

녹는점: 271 oC · >271oC (dec.)
끓는 점: 478.3 · 478.3±45.0 °C(Predicted)
밀도: 1.745 · 1.745±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨, 가열)
산도 계수 (pKa): 5.75 · 5.75±0.20(Predicted)
물리적 상태: 고체
색상: 흰색에서 옅은 베이지까지

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, 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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

신호 어: Warning
유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302

화학 및 산업

상·하류 제품 정보

상류 원료

1-Cyclopropyl-6,7-difluoro-1,4-dihydro-8-methoxy-4-oxo-3-quinolinecarboxylic acid 1-사이클로프로필-6,7-디플루오로-1,4-디하이드로-8-메톡시-4-옥소-3-퀴놀린카르복실산에틸에스테르 다이메틸 설폭사이드 염화칼슘 염산

공급사50 곳

苏州道澜生物医药科技有限公司15952404857 · [email protected]

天津始加生物医药科技有限公司15022261580 · [email protected]

济南百隆化学有限公司[email protected] · [email protected]

艾吉析科技（上海）有限公司17717235263 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

연결된 노트

불러오는 중…