(Pentafluorphenyl)essigsure

(Pentafluorophenyl)acetic acid

HCID 69553
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Grundinformationen

CAS
653-21-4
Standard-SMILES
O=C(O)Cc1c(F)c(F)c(F)c(F)c1F
InChIKey
LGCODSNZJOVMHV-UHFFFAOYSA-N
Summenformel
C8H3F5O2
Durchschnittliche Molmasse
226,1 g/mol
Monoisotopische Masse
226,00532014

Namen und Bezeichner

Bevorzugter Name
(Pentafluorophenyl)acetic acid
IUPAC
2-(2,3,4,5,6-pentafluorophenyl)acetic acid
Lokaler Name
(Pentafluorphenyl)essigsure
Englischer Name
2,3,4,5,6-Pentafluorophenylacetic acid
Summenformel
C8H3F5O2
Molmasse
226.1

Namen und Synonyme

653-21-4(Pentafluorophenyl)acetic acidBenzeneacetic acid, 2,3,4,5,6-pentafluoro-F2HFR5VJK7EINECS 211-497-0DTXSID502156422,3,4,5,6-PENTAFLUOROBENZENEACETIC ACIDRefChem:406809DTXCID80138133211-497-0Pentafluorophenylacetic acid2,3,4,5,6-Pentafluorophenylacetic acid
Weitere Namen anzeigen
RARECHEM AL BO 0298pentaflurobenzalcoholBenzopyrene Impurity 10Pentafluorophenylaceticacid98%PentafluorophenylaceticAcid>Pentafluorophenylacetic acid 98%2,3,4,5,6-PENTAFLUORPHENYLACETIC ACID
2-(Perfluorophenyl)acetic acid2-(2,3,4,5,6-pentafluorophenyl)acetic acidMFCD00004316P1004EN300-23512O105352,3,4,5,6-Pentafluorophenylacetic acid, 99%Z152448270

Datenbank-Bezeichner

CAS
653-21-4
PubChem CID
69553
DTXSID
DTXSID50215642
UNII
F2HFR5VJK7
EC Number
211-497-0
Nikkaji
J205.937A

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,9
Polarare Oberfläche (TPSA)
37,3 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
7
Frei drehbare Bindungen
2
Schwere Atome
15

Physikochemische Eigenschaften

Schmelzpunkt
108 · 108-110 °C(lit.)
Siedepunkt
235.3 · 235.3±35.0 °C(Predicted)
Dichte
1.5096 · 1.5096 (estimate)
storage temp.
Store at room temperature
Löslichkeit
95 % · 95% ethanol: soluble50mg/mL, clear, colorless to very faintly yellow
pka
3.3 · 3.30±0.10(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 7 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 CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.9%)

Sicherheitsdaten

wgk
3
hs_code
29163990
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36
hazard_class
IRRITANT

Chemie und Industrie

Anwendungen

Verwenden2,3,4,5,6-Pentafluorophenylacetic acid has been used in the preparation of:2,3,4,5,6-pentafluorophenylacetyl chloride4-bromo-phenacyl-2,3,4,5,6-pentafluorophenyl acetate

Vor- und nachgelagerte Produkte

Anbieter61 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
常州新氟化学有限公司13275212658 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]

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