기본 정보
- CAS
100361-18-0- 표준 SMILES
O=C(O)c1cn(C2CC2)c2nc(Cl)c(F)cc2c1=O- InChIKey
OXNZWNNMJBOZQO-UHFFFAOYSA-N- 분자식
- C12H8ClFN2O3
- 평균 분자량
- 282.65 g/mol
- 단동위원소 질량
- 282.02074802
이름 및 식별자
- 우선 이름
- 7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid
- IUPAC
- 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid
- 영어명
- 7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid
- 분자식
- C12H8ClFN2O3
- 분자량
- 282.65
이름 및 동의어
100361-18-07-CHLORO-1-CYCLOPROPYL-6-FLUORO-4-OXO-1,4-DIHYDRO-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACID7-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acidDTXSID10453583RefChem:546020DTXCID40404402600-082-31-Cyclopropyl-6-fluoro-7-chloro-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic AcidMFCD084588657-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid1,8-Naphthyridine-3-carboxylic acid, 7-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-
이름 더 보기
7-Chloro-1-cyclopropNalidixic acid cyclopropyl7-Chloro-1-cyclopropyl-6-fluorGemifloxacin 7-Chloro Impurity8-naphthyridine-3-carboxylic acid7-Chloro-1-cyclopropyl-6-fluoro-4-oxo-11-Cyclopropyl-6-fluoro-7-chloride-4-oxo-17-Chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-4-Ox(S)-2-aMino-3-(2,4-diMethylphenyl)propanoic acid1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyl ridine carbox.acid
1-Cyclopropyl-6-fluoro-7-chloride-4-oxo-1,4-dihydro-1,8-napthyridine-3-carboxylic acidSCHEMBL500472AC-298AKOS015849947CS-W003524DS-03991-Cyclopropyl-6-fluoro-7-chloride-4-oxo-1,4-dihydro-1,8-napthyridine-3- carboxylic acidSY021142
데이터베이스 식별자
- CAS
100361-18-0- PubChem CID
- 11055142
- DTXSID
DTXSID10453583- EC Number
- 600-082-3
- Nikkaji
- J3.282.834E
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 70.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 466
물리화학적 성질
- 녹는점
- 209 · 209-212 °C
- 끓는 점
- 485.9 · 485.9±45.0 °C(Predicted)
- 밀도
- 1.727 · 1.727±0.06 g/cm3(Predicted)
- 저장 조건
- Inert atmosphere,Room Temperature
- 물리적 상태
- powder to crystal
- 산도 계수 (pKa)
- 5.96 · 5.96±0.70(Predicted)
- 색상
- 흰색에서 거의 흰색
화학적 성질
Off-white or light yellow powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- HS 번호
- 2933998090
- 기존화학 물질
- 98-3-1055
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