기본 정보
- 표준 SMILES
C=C(C(F)(F)F)C(F)(F)F- InChIKey
QMIWYOZFFSLIAK-UHFFFAOYSA-N- 분자식
- C4H2F6
- 평균 분자량
- 164.05 g/mol
- 단동위원소 질량
- 164.00606938
개요
reactive monomer use in the synthesis of a variety of heat-stable copolymers
이름 및 식별자
- 우선 이름
- 3,3,3-Trifluoro-2-(trifluoromethyl)-1-propene
- IUPAC
- 3,3,3-trifluoro-2-(trifluoromethyl)prop-1-ene
- 현지명
- 헥사플루오로이소부텐
- 영어명
- Hexafluoroisobutene
- 분자식
- C4H2F6
- 분자량
- 164.05
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
382-10-5- PubChem CID
- 91450
- DTXSID
DTXSID9052056- UNII
- P9GQF23ZL8
- EC Number
- 206-840-6
- Nikkaji
- J28.271E
물성
구조 계산 물성
- XLogP
- 3.1
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 121
실험 및 물리화학적 성질
PFAS
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS -> PFAS identified in REACH Regulation EC No. 1272/2008
물리화학적 성질
- 녹는점
- -111 °C · -111°C
- 끓는 점
- 14 · 14,5°C
- 밀도
- 1 · 1,391 g/cm3
- 굴절률
- 1.275 · 1.2750 (estimate)
- 수용성
- 272 mg/L · 272mg/L at 20℃
- InChI
- InChI=1S/C4H2F6/c1-2(3(5,6)7)4(8,9)10/h1H2
- InChIKey
- QMIWYOZFFSLIAK-UHFFFAOYSA-N
- SMILES
- C=C(C(F)(F)F)C(F)(F)F
- LogP
- 2.42 at · 2.42 at 20℃
- EPA
- 3 · 3,3,3-Trifluoro-2-(trifluoromethyl)propene (382-10-5)
안전 및 규제
GHS 분류
GHS Classification
Danger
H280 (70.2%): Contains gas under pressure; may explode if heated [Warning Gases under pressure]
P203, P260, P261, P264, P270, P271, P280, P304+P340, P316, P318, P319, P321, P403+P233, P405, P410+P403, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 161 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 1-Propene, 3,3,3-trifluoro-2-(trifluoromethyl)-
1-Propene, 3,3,3-trifluoro-2-(trifluoromethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propene, 3,3,3-trifluoro-2-(trifluoromethyl)- 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: 08-08-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/20324
안전 데이터
- tsca
- TSCA listed
- ridadr
- 3163
- 독성
- rat,LC50,inhalation,1425ppm/4H (1425ppm),SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYELUNGS, THORAX, OR RESPIRATION: DYSPNEABEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY),United States Environmental Protection Agency, Office of Pesticides and Toxic Substances. Vol. 8EHQ-0683-0476S,
- risk_code
- 23
- hazard_code
- F
- safety_code
- 23-38
- 위험 등급
- GAS
- 기존화학 물질
- KE-34269
- 위험 참고 사항
- Flammable
화학 및 산업
용도 및 제조
General Manufacturing Information
Plastics Material and Resin Manufacturing
1-Propene, 3,3,3-trifluoro-2-(trifluoromethyl)-: ACTIVE
공급사50 곳
관련 반응
연결된 노트
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