Grundinformationen
- Standard-SMILES
O=[N+]([O-])c1ccc(OCC2CO2)cc1- InChIKey
FPIGOBKNDYAZTP-UHFFFAOYSA-N- Summenformel
- C9H9NO4
- Durchschnittliche Molmasse
- 195,17 g/mol
- Monoisotopische Masse
- 195,05315777
Überblick
1,2-epoxy-3-(4-nitrophenoxy)propane is an epoxide that is oxirane substituted by a (4-nitrophenoxy)methyl group. It is an epoxide, an aromatic ether and a C-nitro compound. It is functionally related to a 4-nitrophenol.
Namen und Bezeichner
- Bevorzugter Name
- 2-((4-Nitrophenoxy)methyl)oxirane
- IUPAC
- 2-[(4-nitrophenoxy)methyl]oxirane
- Lokaler Name
- [(p-Nitrophenoxy)methyl]oxiran
- Englischer Name
- 1,2-EPOXY-3-(4-NITROPHENOXY)PROPANE
- Summenformel
- C9H9NO4
- Molmasse
- 195.17
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
5255-75-4- PubChem CID
- 21327
- DTXSID
DTXSID60863512- ChEMBL
CHEMBL33775- ChEBI
CHEBI:508- UNII
- 96071991U0
- EC Number
- 226-057-3
- Nikkaji
- J39.054B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,4
- Polarare Oberfläche (TPSA)
- 67,6 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 14
- Formalladung
- 0
- Komplexität
- 207
Physikochemische Eigenschaften
- Schmelzpunkt
- 54 · 54-55 °C
- Siedepunkt
- 331.83 °C · 331.83°C (rough estimate)
- Dichte
- 1.3544 · 1.3544 (rough estimate)
- Brechungsindex
- 1.57 · 1.5700 (estimate)
- Aggregatzustand
- crystalline solid
- Farbe
- Yellow
- CAS Datenbank
- 5255 · 5255-75-4(CAS DataBase Reference)
- EPA chemische Informationen
- p-Nitrophenyl glycidyl ether (5255-75-4)
Sicherheit und Regulatorisches
Gefahrenhinweise
Sicherheitsdaten
- tsca
- TSCA listed
- hs_code
- 29109000
- Toxizität
- mmo-sat 66 nmol/plate MUREAV 93,297,82
- hazard_code
- C
- hazard_note
- Corrosive
- safety_code
- 24/25
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological Classification
Substances used for the detection, identification, analysis, etc. of chemical, biological, or pathologic processes or conditions. Indicators are substances that change in physical appearance, e.g., color, at or approaching the endpoint of a chemical titration, e.g., on the passage between acidity and alkalinity. Reagents are substances used for the detection or determination of another substance by chemical or microscopical means, especially analysis. Types of reagents are precipitants, solvents, oxidizers, reducers, fluxes, and colorimetric reagents. (From Grant & Hackh's Chemical Dictionary, 5th ed, p301, p499)
Compounds which inhibit or antagonize biosynthesis or actions of proteases (ENDOPEPTIDASES).
Verwendung und Herstellung
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Ergänzende Hinweise
DefinitionChEBI: An epoxide that is oxirane substituted by a (4-nitrophenoxy)methyl group.
Zugehörige Reaktionen
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