기본 정보
- 표준 SMILES
OCC(F)(F)C(F)F- InChIKey
NBUKAOOFKZFCGD-UHFFFAOYSA-N- 분자식
- C3H4F4O
- 평균 분자량
- 132.06 g/mol
- 단동위원소 질량
- 132.0198274
이름 및 식별자
- 우선 이름
- 2,2,3,3-Tetrafluoro-1-propanol
- IUPAC
- 2,2,3,3-tetrafluoropropan-1-ol
- 현지명
- 2,2,3,3-테트라플루오로프로판올
- 영어명
- Tetrafluoro-1-propanol
- 분자식
- C3H4F4O
- 분자량
- 132.06
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
76-37-9- PubChem CID
- 6441
- DTXSID
DTXSID8058796- UNII
- RNO513716P
- EC Number
- 200-955-5
- Nikkaji
- J53.886H
물성
구조 계산 물성
- XLogP
- 1.1
- 극성 표면적
- 20.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 8
- 형식 전하
- 0
- 복잡도
- 71
실험 및 물리화학적 성질
물리화학적 성질
- 녹는점
- -15 °C · -15°C
- 끓는 점
- 109 °C · 109 °C
- 밀도
- 1.48 g/mL · 1.48 g/mL at 20 °C(lit.)
- 굴절률
- 20 · n20/D 1.321(lit.)
- 인화점
- 110 °F · 110 °F
- 저장 조건
- 2 · Sealed in dry,2-8°C
- 물리적 상태
- 액체
- 산도 계수 (pKa)
- 13.05 · 13.05±0.10(Predicted)
- 색상
- 무색의
- Specific Gravity
- 1.481 · 1.481.471
- 수용성
- 물에 용해됩니다.
- Merck
- 14 · 14,9206
- BRN
- 1738264 · 1738264
- Henry's Law Constant
- 1.4 · 1.4×100 mol/(m3Pa) at 25℃, Burkholder et al. (2019)
- 안정성
- 안정적인. 가연성. 강산화제, 강염기, 나트륨, 칼륨, 산 염화물, 산 무수물과 호환되지 않습니다.
- InChI
- 1S/C3H4F4O/c4-2(5)3(6,7)1-8/h2,8H,1H2
- InChIKey
- NBUKAOOFKZFCGD-UHFFFAOYSA-N
- SMILES
- OCC(F)(F)C(F)F
- NIST
- 2 · 2,2,3,3-Tetrafluoro-1-propanol(76-37-9)
- EPA
- 1 · 1-Propanol, 2,2,3,3-tetrafluoro- (76-37-9)
화학적 성질
colourless liquid
안전 및 규제
GHS 분류
GHS Classification
Danger
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids];H302 (53.9%): Harmful if swallowed [Warning Acute toxicity, oral];H319 (85.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H331 (81.9%): Toxic if inhaled [Danger Acute toxicity, inhalation];H332 (17.1%): Harmful if inhaled [Warning Acute toxicity, inhalation]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P303+P361+P353, P304+P340, P305+P351+P338, P316, P317, P321, P330, P337+P317, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 193 reports by companies from 11 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 Information
Chemical: 1-Propanol, 2,2,3,3-tetrafluoro-
Status: Active Update: 29-04-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/23610
2,2,3,3-tetrafluoropropan-1-ol: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
규제 정보
Regulatory Information
Chemical: 1-Propanol, 2,2,3,3-tetrafluoro-
Status: Active Update: 29-04-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/23610
2,2,3,3-tetrafluoropropan-1-ol: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
안전 데이터
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- UB9400000
- ridadr
- UN 1986 3/PG 3
- HS 번호
- 29051990
- risk_code
- 10-20-36-36/37/38
- hazard_code
- Xn,F,Xi
- safety_code
- 26-37/39-16-36/37-36
- 포장분류
- III
- 위험 등급
- 3
- 기존화학 물질
- 97-3-7
- 위험 참고 사항
- Flammable
- Hazard Classifications
- Acute Tox. 3 InhalationEye Irrit. 2Flam. Liq. 3
- 스토리지 클래스
- 3 - Flammable liquids
화학 및 산업
용도 및 제조
응용 분야
용도2,2,3,3-Tetrafluoro-1-propanol, is used as an essential fluorinated fine chemical, the main application of TFP is as a dye solvent in CD-R(W) and DVD-R(W) industry. It is also used in making textile treatment agent and pharmaceuticals. This chemical is an ideal replacement for Freon 22 detergent.
일반 설명2,2,3,3-Tetrafluoro-1-propanol (TFP) is extensively used as the solvent. Mineralization and defluoridation of TFP by UV oxidation in a novel three-phase fluidized bed reactor was reported. Desorption of activated carbon loaded with TFP by supercritical carbon dioxide in a rotating packed bed was investigated.
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