Methyl 4-[(diethoxyphosphoryl)methyl]-3-fluorobenzoate
Grundinformationen
- CAS
158559-76-3- Standard-SMILES
CCOP(=O)(Cc1ccc(C(=O)OC)cc1F)OCC- InChIKey
BNAFOHSNCMFBOU-UHFFFAOYSA-N- Summenformel
- C13H18FO5P
- Durchschnittliche Molmasse
- 304,25 g/mol
- Monoisotopische Masse
- 304,08758883
Namen und Bezeichner
- Bevorzugter Name
- Methyl 4-[(diethoxyphosphoryl)methyl]-3-fluorobenzoate
- IUPAC
- methyl 4-(diethoxyphosphorylmethyl)-3-fluorobenzoate
Namen und Synonyme
158559-76-3methyl 4-[(diethoxyphosphoryl)methyl]-3-fluorobenzoateMethyl 4-((diethoxyphosphoryl)methyl)-3-fluorobenzoateRefChem:815791996-663-7methyl 4-(diethoxyphosphorylmethyl)-3-fluorobenzoatemethyl 4-(diethoxyphosphorylmethyl)-3-fluoro-benzoateC13H18FO5PSCHEMBL4311343BNAFOHSNCMFBOU-UHFFFAOYSA-NAKOS027324998EN300-226031
Weitere Namen anzeigen
diethyl 2-fluoro-4-carbomethoxybenzylphosphonateMethyl 4-(diethoxyphosphorylmethyl)-3-fluorobenzenecarboxylate
Datenbank-Bezeichner
- CAS
158559-76-3- PubChem CID
- 23498922
- EC Number
- 996-663-7
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,7
- Polarare Oberfläche (TPSA)
- 61,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 8
- Schwere Atome
- 20
- Formalladung
- 0
- Komplexität
- 353
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)
Zugehörige Reaktionen
3
Notizen zur Verbindung
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