Grundinformationen
- Standard-SMILES
CCCCCCCCCCI- InChIKey
SKIDNYUZJPMKFC-UHFFFAOYSA-N- Summenformel
- C10H21I
- Durchschnittliche Molmasse
- 268,18 g/mol
- Monoisotopische Masse
- 268,0688
Namen und Bezeichner
- Bevorzugter Name
- 1-Iododecane
- IUPAC
- 1-iododecane
- Lokaler Name
- 1-Ioddecan
- Englischer Name
- 1-IODODECANE
- Summenformel
- C10H21I
- Molmasse
- 268.18
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
2050-77-3- PubChem CID
- 16314
- DTXSID
DTXSID9062142- EC Number
- 218-104-1
- Nikkaji
- J236.232E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 6,3
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 0
- Frei drehbare Bindungen
- 8
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 61
Experimentelle und physikochemische Eigenschaften
Kovats Retention Index
1433
1433
1705;1706;1734
Physikochemische Eigenschaften
- Schmelzpunkt
- -16 ℃ · -16℃
- Siedepunkt
- 132 °C/15 · 132 °C/15 mmHg (lit.)
- Dichte
- 1.257 g/mL · 1.257 g/mL at 25 °C (lit.)
- Dampfdichte
- 5 · >5 (vs air)
- Dampfdruck
- 0.01 mm · 0.01 mm Hg ( 20 °C)
- Brechungsindex
- 20 · n20/D 1.485(lit.)
- Flammpunkt
- 230 °F · >230 °F
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- Aggregatzustand
- Liquid
- Farbe
- Clear colorless
- Wasserlöslichkeit
- Immiscible with water.
- BRN
- 1735228 · 1735228
- InChI
- 1S/C10H21I/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3
- InChIKey
- SKIDNYUZJPMKFC-UHFFFAOYSA-N
- SMILES
- CCCCCCCCCCI
- CAS Datenbank
- 2050 · 2050-77-3(CAS DataBase Reference)
- EPA chemische Informationen
- 1 · Decane, 1-iodo- (2050-77-3)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (87.2%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H413 (80.9%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P261, P264, P264+P265, P271, P273, 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 47 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
Sicherheitsdaten
- F
- 8-10
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29033990
- RTECS-Nr.
- HD8705000
- risk_code
- 36/37/38
- hazard_code
- Xi,F
- hazard_note
- Irritant/Flammable
- safety_code
- 26
- Speicherklasse
- 10 - Combustible liquids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
Verwenden1-Iododecane is used as a precursor to prepare 9-nonadecanone through palladium-catalyzed carbonylative cross-coupling reaction with 9-octyl-9-borabicyclo[3.3.l]nonane. It is also used as an intermediate in organic synthesis.
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