Grundinformationen
- Standard-SMILES
CCCCCCCC(N)=O- InChIKey
LTHCSWBWNVGEFE-UHFFFAOYSA-N- Summenformel
- C8H17NO
- Durchschnittliche Molmasse
- 143,23 g/mol
- Monoisotopische Masse
- 143,13101416
Überblick
Octanamide is a fatty amide resulting from the formal condensation of octanoic acid with ammonia. It is a primary carboxamide and a primary fatty amide. It is functionally related to an octanoic acid.
Namen und Bezeichner
- Bevorzugter Name
- Octanamide
- IUPAC
- octanamide
- Lokaler Name
- Octanamid
- Englischer Name
- N-Octanamide
- Summenformel
- C8H17NO
- Molmasse
- 143.23
Namen und Synonyme
Octanamiden-Octanamide629-01-6Caprylamidecaprylic acid amideUNII-1X5804D710NSC 5515NSC-5515EINECS 211-066-71X5804D710DTXSID4060862CHEBI:142682
Weitere Namen anzeigen
Octanamidn-Octanamide>n-Octanamide
RefChem:167778DTXCID9043564211-066-7InChI=1/C8H17NO/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H2,9,10LTHCSWBWNVGEFE-UHFFFAOYSA-NMFCD00191675octanoylamineoctanoic acid amide
Datenbank-Bezeichner
- CAS
629-01-6- PubChem CID
- 69414
- DTXSID
DTXSID4060862- ChEBI
CHEBI:142682- UNII
- 1X5804D710
- EC Number
- 211-066-7
- Nikkaji
- J6.885C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,4
- Polarare Oberfläche (TPSA)
- 43,1 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 91,3
Experimentelle und physikochemische Eigenschaften
Chemical ClassesIndustrial compound -> amide
SpringerMaterials PropertiesBoiling point
Physikochemische Eigenschaften
- Schmelzpunkt
- 105 °C · 105°C
- Siedepunkt
- 261.35 °C · 261.35°C (rough estimate)
- Dichte
- 0.845 · 0.8450
- Brechungsindex
- 1.4852 · 1.4852 (estimate)
- Löslichkeit
- soluble in Methanol
- Aggregatzustand
- powder to crystal
- pka
- 16.76 · 16.76±0.40(Predicted)
- Farbe
- White to Almost white
- Wasserlöslichkeit
- 4.71 g/L · 4.71g/L(100 ºC)
- EPA chemische Informationen
- Octanamide (629-01-6)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (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
Regulatory Information
Chemical: Octanamide
Octanamide: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- tsca
- TSCA listed
- hs_code
- 2924297099
- risk_code
- 36/37/38
- safety_code
- 26-36
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing InformationOctanamide: ACTIVE
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