Benzene, 1-fluoro-2-(trifluoromethyl)- (HCID 9807)

이름 및 식별자

우선 이름: Benzene, 1-fluoro-2-(trifluoromethyl)-
IUPAC: 1-fluoro-2-(trifluoromethyl)benzene
영어명: 2-Fluorobenzotrifluoride
분자식: C7H4F4
분자량: 164.1

이름 및 동의어

2-Fluorobenzotrifluoride392-85-81-Fluoro-2-(trifluoromethyl)benzeneo-FluorobenzotrifluorideBenzene, 1-fluoro-2-(trifluoromethyl)-NSC 10314o,alpha,alpha,alpha-TetrafluorotolueneEINECS 206-880-4DTXSID6059940RefChem:562484DTXCID9039606InChI=1/C7H4F4/c8-6-4-2-1-3-5(6)7(9,10)11/h1-4

이름 더 보기

uorobenzotrifL2-tetrafluorotoluene2-Fluorobenzotrifluo2-Fluorobezotrifluorideo-fluorotrifluorotoluene2-Fluoro trifluoroMethylà,à,à,2-tetrafluorotoluene

1-FLUORO-2-TRIFLUOROMETHYLBENZENEalpha,alpha,alpha,2-TetrafluorotolueneMFCD000003741-fluoro-2-trifluoromethyl-benzene2-fluoro-1-(trifluoromethyl)benzeneBenzene, fluoro(trifluoromethyl)-alpha,alpha,alpha,Ar-TetrafluorotolueneA,A,A,2-TETRAFLUOROTOLUENE

데이터베이스 식별자

CAS: 392-85-8
PubChem CID: 9807
DTXSID: DTXSID6059940
EC Number: 206-880-4
Nikkaji: J213.623F

물성

구조 계산 물성

XLogP: 3
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 0
무거운 원자 수: 11
형식 전하: 0
복잡도: 129

실험 및 물리화학적 성질

SpringerMaterials Properties13C nuclear magnetic resonance spectrum

물리화학적 성질

녹는점: -49 °C · -49°C
끓는 점: 114 · 114-115 °C750 mm Hg(lit.)
밀도: 1.293 g/mL · 1.293 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.406(lit.)
인화점: 64 °F · 64 °F
저장 조건: 2 · Sealed in dry,2-8°C
물리적 상태: 투명한 액체
Specific Gravity: 1.31 · 1.31
색상: Colorless to Light yellow to Light orange
BRN: 2046638 · 2046638
InChI: InChI=1S/C7H4F4/c8-6-4-2-1-3-5(6)7(9,10)11/h1-4H
InChIKey: BGVGHYOIWIALFF-UHFFFAOYSA-N
SMILES: C1(F)=CC=CC=C1C(F)(F)F
NIST: 1 · Benzene, 1-fluoro-2-(trifluoromethyl)-(392-85-8)
EPA: 1 · Benzene, 1-fluoro-2-(trifluoromethyl)- (392-85-8)

화학적 성질

clear colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: UN 1993 3/PG 2
HS 번호: 29039990
risk_code: 11-36/37/38
hazard_code: F,Xi
safety_code: 16-26-33-24/25-7/9
포장분류: II
위험 등급: 3
위험 참고 사항: Flammable/Irritant
Hazard Classifications: Eye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzene, 1-fluoro-2-(trifluoromethyl)-: INACTIVE

응용 분야

용도2-Fluorobenzotrifluoride was used in the synthesis of 2,2′-bis(trifluoromethylphenoxy)biphenyl via nucleophilic aromatic substitution reaction with 2,2′-biphenol.