기본 정보
- CAS
669066-35-7- 표준 SMILES
N#Cc1nccc(I)c1F- InChIKey
CLBCNDXLHUIEBW-UHFFFAOYSA-N- 분자식
- C6H2FIN2
- 평균 분자량
- 248 g/mol
- 단동위원소 질량
- 247.92467
이름 및 식별자
- 우선 이름
- 3-Fluoro-4-iodopyridine-2-carbonitrile
- IUPAC
- 3-fluoro-4-iodopyridine-2-carbonitrile
- 현지명
- 3-플루오로-4-요오도피리딘-2-카르보니트릴
- 영어명
- 3-Fluoro-4-iodopyridine-2-carbonitrile
- 분자식
- C6H2FIN2
- 분자량
- 248
이름 및 동의어
669066-35-73-fluoro-4-iodopyridine-2-carbonitrileDTXSID20610569RefChem:279424DTXCID60561324845-939-43-FLUORO-4-IODOPICOLINONITRILEMFCD186330963-fluoro-4-iodo-pyridine-2-carbonitrile3-fluoro-4-iodo-2-pyridinecarbonitrile2-Pyridinecarbonitrile, 3-fluoro-4-iodo-SCHEMBL2596919
이름 더 보기
3-플루오로-4-요오도피리딘-2-카르보니트릴
CLBCNDXLHUIEBW-UHFFFAOYSA-N3-fluoro4-iodopyridine-2-carbonitrileAKOS016016023CS-W0039583-Fluoro-4-Iodopyridine-2-CyanopyridineDS-10416SY116054DB-228609
데이터베이스 식별자
- CAS
669066-35-7- PubChem CID
- 21075867
- DTXSID
DTXSID20610569- EC Number
- 845-939-4
물성
구조 계산 물성
- XLogP
- 1.7
- 극성 표면적
- 36.7 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 164
물리화학적 성질
- 끓는 점
- 282 ℃ · 282℃
- 밀도
- 2.11 · 2.11
- 인화점
- 124 ℃ · 124℃
- 저장 조건
- 2 · 2-8°C, protect from light
- 산도 계수 (pKa)
- -4.13 · -4.13±0.18(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]；H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): 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 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (75%): 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 4 reports by companies from 4 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
Regulatory InformationStatus: Active Update: 24-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33118
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (100%)；STOT SE 3 (75%)
규제 정보
Regulatory InformationStatus: Active Update: 24-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33118
화학 및 산업
응용 분야
용도3-Fluoro-4-iodopicolinonitrile is used in preparation of benzofuranyl oral complement factor D inhibitors.
상·하류 제품 정보
상류 원료
공급사48 곳
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海伟聂化工科技有限公司13046668259 · [email protected]
宁波振岳医药科技有限公司19817745290 · [email protected]
上海策嵘生物科技有限公司[email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
石家庄衍晟生物科技有限公司18332018567; 18332018567 · [email protected]
河北松辰医药科技有限公司0319-5801333-8008 15630992918 · [email protected]
南通菡芳生物科技有限公司[email protected] 18017580634 · [email protected]
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