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플루오르벤젠

Fluorobenzene

HCID 10008
새 노트새 반응견적 요청하기
인쇄 미리보기
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
462-06-6
표준 SMILES
Fc1ccccc1
InChIKey
PYLWMHQQBFSUBP-UHFFFAOYSA-N
분자식
C6H5F
평균 분자량
96.1 g/mol
단동위원소 질량
96.03752832

개요

Fluorobenzene appears as a clear, colorless liquid with a characteristic aromatic odor. About the same density as water. Flash point 5 °F. Vapors heavier than air. May irritate the skin, eyes, and mucous membranes. Used as an insecticide, larvacide and as a reagent for plastic or resin polymers.

이름 및 식별자

우선 이름
Fluorobenzene
IUPAC
fluorobenzene
현지명
플루오르벤젠
영어명
Fluorobenzene
분자식
C6H5F
분자량
96.1

이름 및 동의어

FLUOROBENZENE462-06-6Phenyl fluorideMonofluorobenzeneBenzene, fluoro-FluorbenzolDTXSID4025329benzene fluorideEINECS 207-321-7NSC 68416G3TSZ68K12AI3-28560
이름 더 보기
플루오로벤젠플루오르벤젠PhenylfluorideFluorine benzenefluoro-benzen48943uorobenzeneFluorobenzenesbenzene,fluoro-
NSC-68416FLUOROBENZENE [MI]CHEBI:5115DTXCID305329EC 207-321-7benzene, fluoroRefChem:599417207-321-7

데이터베이스 식별자

CAS
462-06-6
PubChem CID
10008
DTXSID
DTXSID4025329
ChEMBL
CHEMBL16070
ChEBI
CHEBI:5115
UNII
G3TSZ68K12
EC Number
207-321-7
Nikkaji
J43.543K

물성

구조 계산 물성

XLogP
2.3
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
0
무거운 원자 수
7
형식 전하
0
복잡도
46.1

실험 및 물리화학적 성질

Chemical ClassesFlammable agents - 3rd degree
SolventsSolvents -> Other Solvents
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP2.01
Density · 2건

1.0225 at 68 °F (USCG, 1999) - Denser than water; will sink

1.024 @25 °C

Solubility1 to 10 mg/mL at 68 °F (NTP, 1992)
Flash Point5 °F (NTP, 1992)
Boiling Point · 2건

185.2 °F at 760 mmHg (NTP, 1992)

85.2 °C @760 [mm Hg]

Melting Point · 2건

-42.2 °F (NTP, 1992)

-40 °C

Vapor Density3.31 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure · 2건

60 mmHg at 67.3 °F ; 100 mmHg at 86.7 °F (NTP, 1992)

77.2 [mmHg]

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 0.7% (2 of 300) of reports.

Danger

H225 (99%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P264+P265, P273, P280, P303+P361+P353, P305+P351+P338, P305+P354+P338, P317, P337+P317, P370+P378, P391, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 300 reports by companies from 16 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 4건

Chemical: Benzene, fluoro-

REACH registered substance: Fluorobenzene (EC: 207-321-7)

Fluorobenzene: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelFlammable Liquid
Fire Hazards · 2건

Special Hazards of Combustion Products: Burning in open flame can form toxic hydrogen fluoride gases.

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.

Health Hazards · 2건

Irritating to skin, eyes and mucous membranes. Repeated exposure of skin may cause dermatitis due to defatting action. Chronic inhalation of vapors or mist may result to damage to lungs, liver and kidneys. Acute vapor exposures can cause symptoms ranging from coughing to transient anesthesia and central nervous system depression. (USCG, 1999)

· May cause toxic effects if inhaled or absorbed through skin.

Hazards Summary · 1건

화학 및 산업

용도 및 제조

Uses · 2건

Used to control carbon content in steel manufacturing, as an identification reagent for plastic and resin polymers, and as an intermediate for insecticides and larvicides; [NTP] Used as an intermediate for pharmaceuticals, pesticides, and other organic compounds; [EPA - PPRTV]

Steel Producing [Category: Industry]

General Manufacturing InformationBenzene, fluoro-: ACTIVE
응용 분야 · 3건

개요Fluorobenzene is a colourless, highly flammable liquid, stable and incompatible with oxidising agents. It is not compatible with oxidising agents such as perchlorates, peroxides, permanganates, chlorates, nitrates, chlorine, bromine and fluorine, ammonium nitrate, chromic acid, halogens, and nitric acid. It is used as an insecticide and as a reagent for plastic and resin polymers.

용도Fluorobenzene is used as a reagent for plastic or resin polymers. It acts as a solvent for highly reactive species. On fluorination of fluorobenzene it gives 1,2-difluorobenzene. It is also used as a material in making medicine.

일반 설명A clear, colorless liquid with a characteristic aromatic odor. About the same density as water. Flash point 5°F. Vapors heavier than air. May irritate the skin, eyes, and mucous membranes. Used as an insecticide, larvacide and as a reagent for plastic or resin polymers.

상·하류 제품 정보

상류 원료

일산화탄소(가스)사이클로헥세인TRIFLUOROACETIC ANHYDRIDE 10X1MLNitrobenzene아질산 나트륨

관련 반응

354건
반응 기록 만들기
HRID 5809 반응식
HRID 5809반응물로uspto-grants-1993_09
HRID 26693 반응식
HRID 26693반응물로uspto-grants-1979_04
HRID 35300 반응식
HRID 35300반응물로uspto-grants-1988_08
HRID 35306 반응식
HRID 35306반응물로uspto-grants-1988_08
HRID 35312 반응식
HRID 35312반응물로uspto-grants-1988_08
HRID 35989 반응식
HRID 35989반응물로uspto-grants-1995_05
HRID 44441 반응식
HRID 44441반응물로uspto-grants-2013_09
HRID 65525 반응식
HRID 65525반응물로uspto-grants-1986_09
1 / 45 페이지

화합물 노트

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이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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Physical Description · 2건

Fluorobenzene appears as a clear, colorless liquid with a characteristic aromatic odor. About the same density as water. Flash point 5 °F. Vapors heavier than air. May irritate the skin, eyes, and mucous membranes. Used as an insecticide, larvacide and as a reagent for plastic or resin polymers.

Liquid with an odor of benzene; [Merck Index] Colorless liquid with an aromatic odor; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
-42 °C · -42 °C
끓는 점
85 °C · 85 °C(lit.)
밀도
1.024 g/mL · 1.024 g/mL at 25 °C(lit.)
증기 밀도
3.31 · 3.31 (vs air)
증기압
81 hPa · 81hPa at 20℃
굴절률
20 · n20/D 1.465(lit.)
인화점
9 °F · 9 °F
저장 조건
2 · 2-8°C
용해도
1.54 g/L · 1.54g/L
물리적 상태
액체
색상
무색의
Specific Gravity
1.024 · 1.024
폭발한계
1.3 · 1.3-8.9%(V)
수용성
불용성
비열
1.52 J/ · Cp(liquid): 1.52 J/(g·K), at 25℃
Merck
14 · 14,4170
BRN
1236623 · 1236623
Henry's Law Constant
1.5 · 1.5×10-3 mol/(m3Pa) at 25℃, Brockbank (2013)
Dielectric constant
4.7 · 4.7(60℃)
안정성
안정적인. 산화제와 호환되지 않습니다. 인화성이 높으며 인화점이 낮습니다.
주요 응용
환경
InChI
1S/C6H5F/c7-6-4-2-1-3-5-6/h1-5H
InChIKey
PYLWMHQQBFSUBP-UHFFFAOYSA-N
SMILES
Fc1ccccc1
LogP
2.27 at · 2.27 at 25℃
NIST
Benzene, fluoro-(462-06-6)
EPA
Fluorobenzene (462-06-6)

화학적 성질

Fluorobenzene is a colorless liquid.

Causes general anesthesia in inhalation lethal-concentration studies of mice; [RTECS] A 28-day inhalation study of rats produced adaptive liver changes (not considered toxicologically significant), and increased fluoride concentrations in bones and teeth; Not likely to cause developmental toxicity or teratogenicity, based on software modeling and a structurally similar compound (chlorobenzene); [EPA ChAMP: Submissions - Submission] May cause smarting and reddening of skin if spilled and allowed to remain on clothes; Vapor exposure may cause coughing, transient anesthesia, and CNS depression; Chronic inhalation exposure may cause lung, liver, and kidney injury; [CHRIS] A skin, eye, nose, and throat irritant; [ToxPlanet: FAHG] An irritant; [NTP] A mild skin and strong eye irritant; Vapors may cause narcotic effects; [Alfa Aesar MSDS] See Chlorobenzene.

DOT ID and Guide2387 130
Reactive GroupAryl Halides
Reactivity AlertsHighly Flammable
Reactivity ProfileIncompatible with strong oxidizing agents. (NTP, 1992)
DOT Hazard Classification · 4건

Fluorobenzene

UN2387

Class 3 Flammable and combustible liquid (49 eCFR § 173.120)

PG II: the degree of danger presented by the material is medium

Air and Water ReactionsHighly flammable. Slightly soluble in water.
Hazard Classes and Categories · 2건

Flam. Liq. 2 (99%)

Flammable agents - 3rd degree

안전 및 보호

Fire FightingExcerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:
Accidental Release Measures · 2건

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:
Isolation and Evacuation · 2건

Excerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:

Immediate precautionary measure

Protective Action Criteria (PAC) · 3건

24 [mg/m3]

260 [mg/m3]

1600 [mg/m3]

Personal Protective Equipment (PPE)Organic vapor-acid gas respirator where appropriate; neoprene or vinyl gloves; chemical safety spectacles, plus face shield where appropriate; rubber footwear; apron or impervious clothing for splash protection; hard hat. (USCG, 1999)
Emergency Response Planning GuidelinesCAUTION: The majority of these products have a very low flash point. Use of water spray when fighting fire may be inefficient.

독성 정보

Adverse EffectsNeurotoxin - Acute solvent syndrome
Toxicity DataLC50 (rat) = 26,908 mg/m3
RAIS Toxicity Values · 2건

0.03

SCREEN Current

EPA Provisional Peer-Reviewed Toxicity Values · 4건

Fluorobenzene

PDF Document

Inadequate information to assess carcinogenic potential

2011

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
DA0800000
ridadr
UN 2387
HS 번호
29039990
risk_code
36/37/38-11-39/23/24/25-23/24/25-52/53-36
hazard_code
F,Xi,T
safety_code
16-26-36-7-33-29-45-36/37-61-7/9
포장분류
II
위험 등급
3
기존화학 물질
KE-17006
위험 참고 사항
Flammable
Hazard Classifications
Aquatic Chronic 2Eye Dam. 1Flam. Liq. 2
스토리지 클래스
3 - Flammable liquids
붕불화수소산
아닐린
불산

하류 제품

플루바스타틴나트륨염4-Fluorothiophenol2-(다이메틸아미노)-1-(4-(4-몰폴리닐)페닐)-2-(페닐메틸)- 1-부타논p-플루오로미트로벤젠2,4-디플로로벤조페논Flunarizine dihydrochlorideFlubendazole비스(4-플루오르페닐)케톤2-클로로-4'-플루오로벤조페논1,3-디클로로-4-플로오르벤젠1-(2,4-디클로로-5-플루오로페닐)에테인원이마조단할로페리돌Penfluridol1-((비스(4-플루오로페닐)메틸실릴)메틸)-1H-1,2,4-트리아졸Cisapride4-브로모플로르벤젠3-(4-플루오로벤조일)프로피오닉 산4-Fluoro-3-phenoxybenzaldehyde3-Chloro-4-fluoronitrobenzene

추가 설명

정의ChEBI: The simplest member of the class of monofluorobenzenes that is benzene carrying a single fluoro substituent.