Grundinformationen
- Standard-SMILES
CCCI- InChIKey
PVWOIHVRPOBWPI-UHFFFAOYSA-N- Summenformel
- C3H7I
- Durchschnittliche Molmasse
- 169,99 g/mol
- Monoisotopische Masse
- 169,95924822
Überblick
Iodopropanes appears as a colorless liquid that discolors in air. Denser than water. The vapors are heavier than air. May be mildly toxic by inhalation. Used as a solvent and to make pharmaceuticals.
Namen und Bezeichner
- Bevorzugter Name
- 1-Iodopropane
- IUPAC
- 1-iodopropane
- Lokaler Name
- 1-Iodpropan
- Englischer Name
- 1-Iodopropane
- Summenformel
- C3H7I
- Molmasse
- 169.99
Namen und Synonyme
1-IODOPROPANE107-08-4Propyl iodidePropane, 1-iodo-ND3629KE2KDTXSID501015653RefChem:869737DTXCID3037595203-460-2n-Propyl iodidePropane, iodo-1-iodo-propane
Weitere Namen anzeigen
n-C3H7IPropyljodid1-Iodpropanen-Propyliodid1-iodo-propanproopyl iodide
IODOPROPANE1-Jodpropan26914-02-3MFCD00001095PROPYLIODIDE1-Jodpropan [Czech]Propane Iodide; Propyl Iodide; n-Propyl Iodideiodopropan
Datenbank-Bezeichner
- CAS
107-08-4、26914-02-3- PubChem CID
- 33643
- DTXSID
DTXSID501015653- UNII
- ND3629KE2K
- EC Number
- 203-460-2
- Nikkaji
- J4.051G
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,6
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 0
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 4
- Formalladung
- 0
- Komplexität
- 7,2
Experimentelle und physikochemische Eigenschaften
Chemical Classes
Other Classes -> Halogenated Aliphatics, Saturated
Flammable agents - 2nd degree
SpringerMaterials PropertiesCoriolis coupling
LogP2.54
Vapor Pressure43.1 [mmHg]
Physical Description
Iodopropanes appears as a colorless liquid that discolors in air. Denser than water. The vapors are heavier than air. May be mildly toxic by inhalation. Used as a solvent and to make pharmaceuticals.
Colorless or yellowish liquid; [Merck Index]
Physikochemische Eigenschaften
- Schmelzpunkt
- -101 °C · -101 °C
- Siedepunkt
- 101 · 101-102 °C(lit.)
- Dichte
- 1.743 g/mL · 1.743 g/mL at 25 °C(lit.)
- Dampfdruck
- 43 mm · 43 mm Hg ( 25 °C)
- Brechungsindex
- 20 · n20/D 1.504(lit.)
- Flammpunkt
- 112 °F · 112 °F
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- 1.1 g/l · 1.1g/l
- Aggregatzustand
- Liquid
- Farbe
- Clear colorless to yellow
- Wasserlöslichkeit
- Fully miscible in water.
- Merck
- 14 · 14,7862
- BRN
- 505937 · 505937
- Henry's Law Constant
- (x 10-3 atmm3/mol): 9.09 at 25 °C (Hine and Mookerjee, 1975)
- Dielectric constant
- 7.09 · 7.0899999999999999
- Stabilität
- Stable, but may discolour on exposure to light. Incompatible with strong oxidizing agents, strong bases. Flammable.
- InChI
- 1S/C3H7I/c1-2-3-4/h2-3H2,1H3
- InChIKey
- PVWOIHVRPOBWPI-UHFFFAOYSA-N
- SMILES
- CCCI
- CAS Datenbank
- 107 · 107-08-4(CAS DataBase Reference)
- NIST chemische Informationen
- 1 · Propane, 1-iodo-(107-08-4)
- EPA chemische Informationen
- 1 · Propane, 1-iodo- (107-08-4)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 50 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Propane, 1-iodo-
Status: Active Update: 01-02-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/22093
1-Iodopropane: Does not have an individual approval but may be used under an appropriate group standard
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
DOT LabelFlammable Liquid
Fire HazardsExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Health HazardsExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Hazards SummaryAn irritant; Harmful by inhalation; [Alfa Aesar MSDS]
Reactive GroupHalogenated Organic Compounds
Reactivity AlertsHighly Flammable
Reactivity Profile
Halogenated aliphatic compounds, such as IODOPROPANE, are moderately or very reactive. Halogenated organics generally become less reactive as more of their hydrogen atoms are replaced with halogen atoms. Low molecular weight haloalkanes are highly flammable and can react with some metals to form dangerous products. Materials in this group are incompatible with strong oxidizing and reducing agents. Also, they are incompatible with many amines, nitrides, azo/diazo compounds, alkali metals, and epoxides.
Air and Water ReactionsHighly flammable. Slightly soluble in water.
Hazard Classes and Categories
Flam. Liq. 3 (100%)
Flammable agents - 2nd degree
Sicherheit und Schutzausrüstung
Fire FightingExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
First AidExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Nonfire Spill ResponseExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Isolation and EvacuationExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Personal Protective Equipment (PPE)Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Toxikologische Informationen
Toxicity DataLC50 (rat) = 73,000 mg/m3/30min
Sicherheitsdaten
- F
- 8
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2392 (IODOPROPANES)
- hs_code
- 29033080
- RTECS-Nr.
- TZ4100000
- risk_code
- 10-20-36/37/38-52/53-2017/10/20
- Toxizität
- LD50 (inhalation) for rats 73,000 mg/m3/30-min (quoted, RTECS, 1985).
- hazard_code
- Xn,Xi,N
- hazard_note
- Irritant
- safety_code
- 16-26-36/37-61
- hazard_class
- 3
- packing_group
- III
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Acute Tox. 4 InhalationAquatic Chronic 1Carc. 2Eye Irrit. 2Flam. Liq. 3Muta. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Pharmakologische Informationen
Metabolism/Metabolites1-iodopropane has known human metabolites that include propyl-glutathione.
Verwendung und Herstellung
General Manufacturing InformationPropane, 1-iodo-: ACTIVE
Anwendungen
Verwenden1-Iodopropane is used in wide range of medicals industrial applications as well as in human and animal nutrition products, pharmaceutical intermediates, polarizing films for Liquid Crystal Display (LCD) chemicals. Iodine derivatives are also used as organic building blocks, analytical reagents etc. It is also used as a solvent and intermediate of organic synthesis.
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