펜타플루오로프로피오닐플루오라이드

Perfluoropropionyl fluoride

HCID 67912CAS 422-61-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: O=C(F)C(F)(F)C(F)(F)F
InChIKey: YLCLKCNTDGWDMD-UHFFFAOYSA-N
분자식: C3F6O
평균 분자량: 166.02 g/mol
단동위원소 질량: 165.98533394

이름 및 식별자

우선 이름: Perfluoropropionyl fluoride
IUPAC: 2,2,3,3,3-pentafluoropropanoyl fluoride
현지명: 펜타플루오로프로피오닐플루오라이드
영어명: Pentafluoropropionyl fluoride
분자식: C3F6O
분자량: 166.02

이름 및 동의어

Pentafluoropropionyl fluoride422-61-7Perfluoropropionyl fluoride2,2,3,3,3-pentafluoropropanoyl fluoridePropanoyl fluoride, pentafluoro-EINECS 207-019-5DTXSID4059968Propanoyl fluoride, 2,2,3,3,3-pentafluoro-RefChem:860297Propanoyl fluoride, pentafluoroDTXCID4040056Propanoyl fluoride, 2,2,3,3,3pentafluoro

이름 더 보기

펜타플루오로프로피오닐플루오라이드perfluoropropanoyl fluoridepentafluoro-propanoylfluoridPentafluoropropionylfluoride97%Pentafluoropropionyl fluoride 97%1,2,2,3,3,3-Hexafluoro-1-propanone2,2,3,3,3-Pentafluoropropionyl fluoride

207-019-5MFCD00042078pentafluoropropanoyl fluoridePropanoyl fluoride,2,2,3,3,3-pentafluoro-CF3CF2COFC2F5COFSCHEMBL428729perfluoropropionic acid fluoride

데이터베이스 식별자

CAS: 422-61-7
PubChem CID: 67912
DTXSID: DTXSID4059968
EC Number: 207-019-5
Nikkaji: J196.092J

물성

구조 계산 물성

XLogP: 2
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 7
회전 가능 결합 수: 1
무거운 원자 수: 10
형식 전하: 0
복잡도: 146

실험 및 물리화학적 성질

Chemical ClassesToxic Gases & Vapors -> Acid Halides

PFAS · 2건

PFAS -> Other/unspecified

Physical Description · 2건

CBI

Liquefied gas; [Alfa Aesar MSDS]

물리화학적 성질

끓는 점: -30 °C · -30°C
밀도: 1.537 · 1.537±0.06 g/cm3(Predicted)
EPA: Propanoyl fluoride, pentafluoro- (422-61-7)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H280 (100%): Contains gas under pressure; may explode if heated [Warning Gases under pressure]

P260, P271, P284, P304+P340, P316, P320, P403+P233, P405, P410+P403, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Propanoyl fluoride, 2,2,3,3,3-pentafluoro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanoyl fluoride, 2,2,3,3,3-pentafluoro- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 15-01-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/30339

Hazards SummaryLC50 (mouse) greater than 25 ppm/4hr but less than 100 ppm/4hr; [EPA - TSCATS] Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Alfa Aesar MSDS] See Propionyl chloride.

Hazard Classes and CategoriesPress. Gas (Liq.) (100%)

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

tsca: TSCA listed
ridadr: 3308
risk_code: 34
hazard_code: C,T
safety_code: 26-36/37/39
위험 등급: GAS, TOXIC, CORROSIVE
위험 참고 사항: Corrosive

화학 및 산업

용도 및 제조

U.S. Production2023: 1,000,000 - <5,000,000 lb

Industry UsesIntermediate

General Manufacturing Information · 2건

All Other Basic Organic Chemical Manufacturing

Propanoyl fluoride, 2,2,3,3,3-pentafluoro-: ACTIVE

응용 분야

용도Pentafluoropropionyl Fluoride is used as a reagent in the synthesis of perfluoroallyl fluorosulfate (FAFS) as a building block for fluoroallylic compounds.