Grundinformationen
- Standard-SMILES
COc1ccc(F)c(B(O)O)c1- InChIKey
IPTZOWYBCLEBOE-UHFFFAOYSA-N- Summenformel
- C7H8BFO3
- Durchschnittliche Molmasse
- 169,95 g/mol
- Monoisotopische Masse
- 170,05505274
Namen und Bezeichner
- Bevorzugter Name
- 2-Fluoro-5-methoxyphenylboronic acid
- IUPAC
- (2-fluoro-5-methoxyphenyl)boronic acid
- Englischer Name
- 2-Fluoro-5-methoxyphenylboronic acid
- Summenformel
- C7H8BFO3
- Molmasse
- 169.95
Namen und Synonyme
2-Fluoro-5-methoxyphenylboronic acid406482-19-7(2-fluoro-5-methoxyphenyl)boronic acidDTXSID60400047RefChem:472483DTXCID70350903689-882-1MFCD04974115BORONIC ACID, (2-FLUORO-5-METHOXYPHENYL)-SCHEMBL931782B-(2-FLUORO-5-METHOXYPHENYL)-BORONIC ACID2-FLUORO-5-METHOXYBENZENEBORONIC ACID
Weitere Namen anzeigen
3-Borono-4-fluoroanisole2-Fluoro-5-methoxyphenylboronicaci2-Fluoro-5-methoxyphenylboronic acid >=95%Boronic acid, B-(2-fluoro-5-Methoxyphenyl)-2-Fluoro-5-methoxyphenylboronic acid, 98.5%2-fluoro-5-methoxyphenylboronic acid, 98%min2-Fluoro-5-methoxyphenylboronic acid - [F3230]Boronic acid, (2-fluoro-5-methoxyphenyl)- (9CI)
(2-fluoro-5-methoxy-phenyl)boronic Acid2-FLUORO-5-METHOXYPHENYLBORONICACID2-fluoro-5met4TA7GA3D6QSCHEMBL294546192-fluoro-5methoxyphenylboronic acid5-methoxy-2-fluorophenylboronic acidSBB071214
Datenbank-Bezeichner
- CAS
406482-19-7- PubChem CID
- 4157211
- DTXSID
DTXSID60400047- UNII
- 4TA7GA3D6Q
- EC Number
- 689-882-1
- Nikkaji
- J2.687.189A
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 49,7 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 145
Physikochemische Eigenschaften
- Schmelzpunkt
- 194 · 194-196 °C (lit.)
- Siedepunkt
- 333.1 · 333.1±52.0 °C(Predicted)
- Dichte
- 1.26 · 1.26±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 7.9 · 7.90±0.58(Predicted)
- Aggregatzustand
- Solid
- Farbe
- White to yellow
- InChI
- 1S/C7H8BFO3/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,10-11H,1H3
- InChIKey
- IPTZOWYBCLEBOE-UHFFFAOYSA-N
- SMILES
- COc1ccc(F)c(c1)B(O)O
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/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 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 29319090
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 28B-26
- Speicherklasse
- 13 - Non Combustible Solids
Chemie und Industrie
Anwendungen
Verwendensuzuki reaction
Anbieter50 Anbieter
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