5-Fluoro-2-methylphenol
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Grundinformationen
- CAS
452-85-7- Standard-SMILES
Cc1ccc(F)cc1O- InChIKey
CKJOSIHYVLHIER-UHFFFAOYSA-N- Summenformel
- C7H7FO
- Durchschnittliche Molmasse
- 126,13 g/mol
- Monoisotopische Masse
- 126,04809301
Namen und Bezeichner
- Bevorzugter Name
- 5-Fluoro-2-methylphenol
- IUPAC
- 5-fluoro-2-methylphenol
- Englischer Name
- 5-Fluoro-2-methylphenol
- Summenformel
- C7H7FO
- Molmasse
- 126.13
Namen und Synonyme
5-Fluoro-2-methylphenol452-85-7DTXSID20379129RefChem:102632DTXCID80330155610-240-34-Fluoro-2-hydroxytoluene5-Fluoro-o-cresolMFCD006730095-fluoro-2-methyl-phenolPhenol, 5-fluoro-2-methyl-AKOS005254864
Weitere Namen anzeigen
5-Fluoro-o-cresol>5-FLUORO-2-METHYLPHENOL5-Fluoro-o-cresol (OH=1)5-Fluoro-2-methylphenol 98%5-Fluoro-2-methylphenol,98%4-Fluoro-2-hydroxytoluene 5-Fluoro-2-4-Fluoro-2-hydroxytoluene, 5-Fluoro-o-cresol
CS-W011163AC-3098PS-9181BP-10225CKJOSIHYVLHIER-A1710AM20060356FT-0620403
Datenbank-Bezeichner
- CAS
452-85-7- PubChem CID
- 2774616
- DTXSID
DTXSID20379129- EC Number
- 610-240-3
- Nikkaji
- J801.751D
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 2,1
- Polarare Oberfläche (TPSA)
- 20,2 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 94
Physikochemische Eigenschaften
- Siedepunkt
- 66 °C · 66°C 4mm
- Dichte
- 1 · 1,157 g/cm3
- Brechungsindex
- 1.514 · 1.514
- Flammpunkt
- 66 °C/4mm · 66°C/4mm
- storage temp.
- 2 · 2-8°C
- Aggregatzustand
- clear liquid
- pka
- 9.32 · 9.32±0.10(Predicted)
- Wichte
- 1.157 · 1.157
- Farbe
- Colorless to Red to Green
- BRN
- 3234863 · 3234863
- InChI
- InChI=1S/C7H7FO/c1-5-2-3-6(8)4-7(5)9/h2-4,9H,1H3
- InChIKey
- CKJOSIHYVLHIER-UHFFFAOYSA-N
- SMILES
- C1(O)=CC(F)=CC=C1C
- CAS Datenbank
- 452 · 452-85-7(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H227 (10%): Combustible liquid [Warning Flammable liquids]；H302+H312 (10%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oral; acute toxicity, dermal]；H302 (60%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (60%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (70%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (30%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (10%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (30%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (30%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 10 reports by companies from 5 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.
Gefahrenhinweise
Hazard Classes and CategoriesFlam. Liq. 4 (10%)；Acute Tox. 4 (60%)；Acute Tox. 4 (60%)；Skin Corr. 1C (70%)；Skin Irrit. 2 (30%)；Eye Dam. 1 (10%)；Eye Irrit. 2 (30%)；STOT SE 3 (30%)
Sicherheitsdaten
- ridadr
- 3265
Chemie und Industrie
Anwendungen
Verwenden5-Fluoro-2-methylphenol is a phenolic compound with methyl and fluorine atom substituents at the 2 and 5 positions. It is widely used as a raw material for the preparation of other organic compounds or pharmaceutical intermediates.
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