CAS 96568-07-9 Ethyl 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate (HCID 11722954)

기본 정보

CAS: 96568-07-9
표준 SMILES: CCOC(=O)c1cn(C2CC2)c2nc(Cl)c(F)cc2c1=O
InChIKey: RWCZOVMOKFTUAD-UHFFFAOYSA-N
분자식: C14H12ClFN2O3
평균 분자량: 310.71 g/mol
단동위원소 질량: 310.0520481

이름 및 식별자

우선 이름: Ethyl 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylate
IUPAC: ethyl 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylate
영어명: 7-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid Ethyl Ester
분자식: C14H12ClFN2O3
분자량: 310.71

이름 및 동의어

96568-07-9Ethyl 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylateDTXSID30471143RefChem:344633DTXCID60421959Ethyl 1-Cyclopropyl-7-chloro-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthylridine carboxylateEthyl 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylateMFCD08458313C14H12ClFN2O37-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acid ethyl esterethyl 1-cyclopropyl-6-fluoro-7-chloro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylate7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-[1,8]naphthyridine-3-carboxylic Acid Ethyl Ester;

이름 더 보기

4-dihydro-4-oxo-1Ethyl 1-Cyclopropyl-7-Chloro-1-cyclopropyl-6-fluoro-18-naphthyridine-3-carboxylic Acid Ethyl EsterEthyl 1-Cyclopropyl-6-Fluoro-7-Chloro-4-Oxo-1,1-Cyclopropyl-6-fluoro-7-chloride-4-oxo-1,4-dihydro-1,8-napt...1-Cyclopropyl-6-fluoro-7-chloride-4-oxo-1,4-dihydro-1,8-napthyridine-3-carboxylic

물성

구조 계산 물성

XLogP: 3
극성 표면적: 59.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 6
회전 가능 결합 수: 4
무거운 원자 수: 21
형식 전하: 0
복잡도: 495

물리화학적 성질

녹는점: 172 · 172-174°C
끓는 점: 464.2 · 464.2±45.0 °C(Predicted)
밀도: 1.511 · 1.511±0.06 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
용해도: DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 고체
산도 계수 (pKa): -1.35 · -1.35±0.70(Predicted)
색상: 베이지색

화학적 성질

7-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid Ethyl Ester is Light Tan Solid

안전 및 규제

안전 데이터

HS 번호: 2918300090

화학 및 산업

응용 분야

용도7-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid Ethyl Ester is a fluoroquinolone derivative used in the preparation of antibacterial agents.