기본 정보
- CAS
148639-07-0- 표준 SMILES
Fc1c(I)ccnc1Cl- InChIKey
GONULLRFSHKLBS-UHFFFAOYSA-N- 분자식
- C5H2ClFIN
- 평균 분자량
- 257.43 g/mol
- 단동위원소 질량
- 256.89045
이름 및 식별자
- 우선 이름
- 2-Chloro-3-fluoro-4-iodopyridine
- IUPAC
- 2-chloro-3-fluoro-4-iodopyridine
- 영어명
- 2-Chloro-3-fluoro-4-iodopyridine
- 분자식
- C5H2ClFIN
- 분자량
- 257.43
이름 및 동의어
2-Chloro-3-fluoro-4-iodopyridine148639-07-0DTXSID40453955RefChem:258527DTXCID30404774821-637-8Pyridine, 2-chloro-3-fluoro-4-iodo-MFCD04972389SCHEMBL792915AKOS005259352DS-1498AC-33397
이름 더 보기
2-Chloro-3-fluoro-4-iodopyridine 95+%2-CHLORO-3-FLUORO-4-IODOPYRIDINE ISO 9001：2015 REACH
SY022337C33752-chloro-3-fluoro-4-iodo-pyridineAM62433FT-06500312-Chloro-3-fluoro-4-iodoporb3181324SCHEMBL30340481
데이터베이스 식별자
- CAS
148639-07-0- PubChem CID
- 11065087
- DTXSID
DTXSID40453955- EC Number
- 821-637-8
물성
구조 계산 물성
- XLogP
- 2.6
- 극성 표면적
- 12.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 9
- 형식 전하
- 0
- 복잡도
- 103
물리화학적 성질
- 녹는점
- 97 °C · 97 °C
- 끓는 점
- 246.1 · 246.1±35.0 °C(Predicted)
- 밀도
- 2.129 · 2.129±0.06 g/cm3(Predicted)
- 저장 조건
- Keep in dark place,Sealed in dry,Room Temperature
- 용해도
- 메탄올에 용해됨
- 물리적 상태
- powder to crystal
- 산도 계수 (pKa)
- -0.22 · -0.22±0.10(Predicted)
- 색상
- White to Light yellow to Light orange
- InChI
- InChI=1S/C5H2ClFIN/c6-5-4(7)3(8)1-2-9-5/h1-2H
- InChIKey
- GONULLRFSHKLBS-UHFFFAOYSA-N
- SMILES
- C1(Cl)=NC=CC(I)=C1F
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302+H312+H332 (93.3%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]；H302 (96.7%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (96.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (96.7%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (96.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
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)
Aggregated GHS information provided per 30 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (96.7%)；Acute Tox. 4 (96.7%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (96.7%)；STOT SE 3 (96.7%)
안전 데이터
- HS 번호
- 2933399990
화학 및 산업
응용 분야
용도2-Chloro-3-fluoro-4-iodopyridine is a polyhalogenated compound with a wide uses. It is a crucial compound that could be used as a pharmaceutical intermediate in pharmaceutical synthesis and scientific research.
상·하류 제품 정보
상류 원료
공급사100 곳
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