7-Bromo-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

HCID 10132015CAS 119916-34-6

기본 정보

표준 SMILES
Cc1c(F)c(Br)cc2c1c(=O)c(C(=O)O)cn2C1CC1
InChIKey
FMNWEXUSEYKPGZ-UHFFFAOYSA-N
분자식
C14H11BrFNO3
평균 분자량
340.14 g/mol
단동위원소 질량
338.99063

이름 및 식별자

우선 이름
7-Bromo-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
IUPAC
7-bromo-1-cyclopropyl-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid
영어명
7-Bromo-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
분자식
C14H11BrFNO3
분자량
340.14

이름 및 동의어

119916-34-67-BROMO-1-CYCLOPROPYL-6-FLUORO-5-METHYL-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACIDFMNWEXUSEYKPGZ-UHFFFAOYSA-N7-BROMO-1-CYCLOPROPYL-6-FLUORO-5-METHYL-4-OXOQUINOLINE-3-CARBOXYLIC ACIDSCHEMBL5868703DTXSID704360741-cyclopropyl-6-fluoro-7-bromo-5-methyl-1,4- dihydro-4-oxoquinoline-3-carboxylic acid1-cyclopropyl-6-fluoro-7-bromo-5-methyl-1,4-dihydro-4-oxoquinoline-3-carboxylic acid7-Bromo-1-Cyclopropyl-6-Fluoro-5-Methyl-4-Oxo-1,4-Dihydro-3-Quinolinecarboxylic Acid3-Quinolinecarboxylic acid, 7-bromo-1-cyclopropyl-6-fluoro-1,4-dihydro-5-methyl-4-oxo-

데이터베이스 식별자

CAS
119916-34-6
PubChem CID
10132015
DTXSID
DTXSID70436074

물성

구조 계산 물성

XLogP
3.7
극성 표면적
57.6 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
2
무거운 원자 수
20

물리화학적 성질

끓는 점
508.1 · 508.1±50.0 °C(Predicted)
밀도
1.781 · 1.781±0.06 g/cm3(Predicted)
산도 계수 (pKa)
6.37 · 6.37±0.50(Predicted)

관련 반응

12건

연결된 노트

불러오는 중…