2-Iodpropan

Isopropyl iodide

HCID 6362CAS 75-30-9

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Grundinformationen

Standard-SMILES: CC(C)I
InChIKey: FMKOJHQHASLBPH-UHFFFAOYSA-N
Summenformel: C3H7I
Durchschnittliche Molmasse: 169,99 g/mol
Monoisotopische Masse: 169,95924822

Überblick

structure

Namen und Bezeichner

Bevorzugter Name: Isopropyl iodide
IUPAC: 2-iodopropane
Lokaler Name: 2-Iodpropan
Englischer Name: 2-Iodopropane
Summenformel: C3H7I
Molmasse: 169.99

Namen und Synonyme

2-IODOPROPANEIsopropyl iodide75-30-9Propane, 2-iodo-2-Propyl iodidesec-Propyl iodide67K05OPZ0EDTXSID4058788RefChem:792175DTXCID1047736200-859-3isopropyliodide

Weitere Namen anzeigen

2-iodo-propan2-Iodopropane OR Isopropyl Iodideiso-C3H7I2-Iodpropan2-Propyljodid2-propyliodideIsopropyliodid

2-Jodpropan2-IODO-PROPANE1-methylethyl iodideC3H7Ii-Propyl iodideMFCD000010712-Iodopropane (Stabilized with Copper)2-Jodpropan [Czech]

Datenbank-Bezeichner

CAS: 75-30-9
PubChem CID: 6362
DTXSID: DTXSID4058788
UNII: 67K05OPZ0E
EC Number: 200-859-3
Nikkaji: J1.450H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,3
Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 0
Frei drehbare Bindungen: 0
Schwere Atome: 4
Formalladung: 0
Komplexität: 10,8

Experimentelle und physikochemische Eigenschaften

Chemical ClassesOther Classes -> Halogenated Aliphatics, Saturated

SpringerMaterials PropertiesCoriolis coupling

LogP2.89

Vapor Pressure43.1 [mmHg]

Physical DescriptionColorless liquid; Discolored by air and light; [Hawley] Clear faintly yellow-green liquid; May discolor on light exposure; [MSDSonline]

Collision Cross Section154 Å² [M+H]+

Physikochemische Eigenschaften

Schmelzpunkt: -90 °C · -90 °C
Siedepunkt: 90 °C · 90 °C
Dichte: 1.703 g/mL · 1.703 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.498(lit.)
Flammpunkt: 108 °F · 108 °F
storage temp.: 30 °C · Store below +30°C.
Löslichkeit: 1.4 g/l · 1.4g/l
Aggregatzustand: Liquid
Farbe: Clear colorless to light yellow
Wasserlöslichkeit: Soluble in water(1.4g/L).
Merck: 14 · 14,5214
BRN: 1098244 · 1098244
Henry's Law Constant: 8.5 · 8.5×10-4 mol/(m3Pa) at 25℃, Brockbank (2013)
Dielectric constant: 8.19 · 8.1899999999999995
Stabilität: Stable, but may discolour on exposure to light. Air sensitive. Incompatible with strong bases, strong oxidizing agents.
InChI: 1S/C3H7I/c1-3(2)4/h3H,1-2H3
InChIKey: FMKOJHQHASLBPH-UHFFFAOYSA-N
SMILES: CC(C)I
LogP: 2.89 · 2.890
CAS Datenbank: 75 · 75-30-9(CAS DataBase Reference)
NIST chemische Informationen: 2 · Propane, 2-iodo-(75-30-9)
EPA chemische Informationen: 2 · Propane, 2-iodo- (75-30-9)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, 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 57 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: Propane, 2-iodo-

Isopropyl iodide: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryMay cause irritation; May cause skin sensitization; [MSDSonline] Search for the CAS number 75-30-9 found 3 records, none documenting skin sensitization; [PubMed]

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Toxikologische Informationen

Toxicity DataLC50 (rat) = 320,000mg/m3/30min

Sicherheitsdaten

F: 8
wgk: 3
tsca: TSCA listed
ridadr: UN 2392 3/PG 3
hs_code: 29033990
RTECS-Nr.: TZ4200000
risk_code: 10-22-36/37/38
hazard_code: Xn
safety_code: 36/37-37/39-26-16
hazard_class: 3
packing_group: III
Speicherklasse: 3 - Flammable liquids
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2Flam. Liq. 3Skin Irrit. 2