1-Fluor-4-nitrobenzol

p-Fluoronitrobenzene

HCID 9590CAS 350-46-9
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Grundinformationen

Standard-SMILES
O=[N+]([O-])c1ccc(F)cc1
InChIKey
WFQDTOYDVUWQMS-UHFFFAOYSA-N
Summenformel
C6H4FNO2
Durchschnittliche Molmasse
141,1 g/mol
Monoisotopische Masse
141,02260659

Namen und Bezeichner

Bevorzugter Name
p-Fluoronitrobenzene
IUPAC
1-fluoro-4-nitrobenzene
Lokaler Name
1-Fluor-4-nitrobenzol
Englischer Name
4-Fluoronitrobenzene
Summenformel
C6H4FNO2
Molmasse
141.1

Namen und Synonyme

p-FluoronitrobenzeneRefChem:4328404-Fluoronitrobenzene1-FLUORO-4-NITROBENZENE350-46-9p-Nitrofluorobenzene4-NitrofluorobenzeneBenzene, 1-fluoro-4-nitro-4-Fluoro-1-nitrobenzene1-Nitro-4-fluorobenzene178603-76-41-Fluoro-4-nitro-benzene
Weitere Namen anzeigen
4-FluornitrobenzolFluoro-4-nitrobenzFluoronitrobenzene3p-fluoromitrobenzene
MFCD000072824-nitro-1-fluorobenzeneNSC 10281para-fluoronitrobenzene1,4-FluoronitrobenzeneBenzene, 1-fluoro-4-nitro-, labeled with carbon-14 (9CI)A2M2FH7XHHNSC-10281

Datenbank-Bezeichner

CAS
350-46-9
PubChem CID
9590
DTXSID
DTXSID9022025
ChEMBL
CHEMBL163729
UNII
A2M2FH7XHH
EC Number
206-502-8
Nikkaji
J47.809A

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,8
Polarare Oberfläche (TPSA)
45,8 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
0
Schwere Atome
10

Experimentelle und physikochemische Eigenschaften

Chemical ClassesNitrogen Compounds -> Nitros, Aromatic
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Density1.3300 @ 20 °C/4 °C
Color/FormYELLOW NEEDLES
SolubilitySOL IN ALCOHOL, ETHER; INSOL IN WATER
Boiling Point206-207 °C

Physikochemische Eigenschaften

Schmelzpunkt
21 °C · 21 °C (lit.)
Siedepunkt
205 °C · 205 °C (lit.)
Dichte
1.33 g/mL · 1.33 g/mL at 25 °C (lit.)
Dampfdichte
1 · >1 (vs air)
Dampfdruck
5.5 mm · 5.5 mm Hg ( 70 °C)
Brechungsindex
20 · n20/D 1.531(lit.)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

This chemical does not meet GHS hazard criteria for 1% (1 of 102) of reports.

Danger

H302 (88.2%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 102 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Benzene, 1-fluoro-4-nitro-

Status: Active Update: 13-08-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/7274

1-Fluoro-4-nitrobenzene: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryEmergency treatment: Methemoglobinemia; [HSDB] An irritant; [MSDSonline]
Hazard Classes and CategoriesAcute Tox. 4 (88.2%)

Toxikologische Informationen

Ecotoxicity ValuesLC50 Pimephales promelas (fathead minnow) 28.4 mg/l 96 hr flow-through bioassay, wt 0.12 g, water hardness 45.5 mg/l CaCO3, temp: 25 +/- 1 °C, pH 7.5, dissolved oxygen greater than 60% of saturation
Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect
Toxicity DataLC50 (rat) = 2,600 mg/m3/4h

Sicherheitsdaten

wgk
1
tsca
TSCA listed
ridadr
UN 2811 6.1/PG 3
hs_code
29049085
RTECS-Nr.
DA1400000
risk_code
20/21/22-33

Chemie und Industrie

Pharmakologische Informationen

Metabolism/MetabolitesYIELDS N-ACETYL-S-(P-NITROPHENYL)-L-CYSTEINE, P-FLUOROANILINE & P-NITROPHENOL IN RABBITS: BRAY & JAMES, BIOCHEM J 66: 45 (1957); BRAY ET AL, BIOCHEM J 68: 561 (1958). /FROM TABLE/

Verwendung und Herstellung

Uses · 3 Einträge

Used as a component in hair dyes; [HSDB]

Dressing Hair [Category: Other]

A COMPONENT OF HAIR DYES

General Manufacturing InformationBenzene, 1-fluoro-4-nitro-: ACTIVE

Anwendungen

Verwenden1-Fluoro-4-nitrobenzene used as a component of hair dyes, as pharmaceutical intermediates. It is also used for the preparation of novel soluble aromatic polyimides

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
杭州创引化工科技有限公司0571-87086220 13516718938 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

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