4-Iod-m-xylol

4-Iodo-m-xylene

HCID 77885CAS 4214-28-2

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Grundinformationen

Standard-SMILES: Cc1ccc(I)c(C)c1
InChIKey: BUNKQJAMHYKQIM-UHFFFAOYSA-N
Summenformel: C8H9I
Durchschnittliche Molmasse: 232,06 g/mol
Monoisotopische Masse: 231,9749

Namen und Bezeichner

Bevorzugter Name: 4-Iodo-m-xylene
IUPAC: 1-iodo-2,4-dimethylbenzene
Lokaler Name: 4-Iod-m-xylol
Englischer Name: 4-IODO-M-XYLENE
Summenformel: C8H9I
Molmasse: 232.06

Namen und Synonyme

4-Iodo-m-xylene4214-28-21-Iodo-2,4-dimethylbenzeneBenzene, 1-iodo-2,4-dimethyl-NSC 3780EINECS 224-141-44-Iodo-1,3-dimethyl benzeneDTXSID1063356RefChem:99450DTXCID6040038224-141-4BUNKQJAMHYKQIM-UHFFFAOYSA-N

Weitere Namen anzeigen

SKL14574-Iodo-3-xylene4-Iodo-m-xylene>4-Iodo-m-xylene,95%2,4-Dimethylphenyl iodide

InChI=1/C8H9I/c1-6-3-4-8(9)7(2)5-6/h3-5H,1-2H2,4-Dimethyliodobenzene1,3-Dimethyl-4-iodobenzenem-Xylene, 4-iodo-2,4-dimethyl-1-iodobenzeneMFCD00013706NSC-3780iodo-m-xylene

Datenbank-Bezeichner

CAS: 4214-28-2
PubChem CID: 77885
DTXSID: DTXSID1063356
UNII: L963Q2G47M
EC Number: 224-141-4
Nikkaji: J104.343I

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,3
Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 0
Frei drehbare Bindungen: 0
Schwere Atome: 9
Formalladung: 0
Komplexität: 90

Experimentelle und physikochemische Eigenschaften

Kovats Retention Index1234.1

Physikochemische Eigenschaften

Schmelzpunkt: -2.9 °C · -2.9°C (estimate)
Siedepunkt: 105 · 105-106 °C5 mm Hg(lit.)
Dichte: 1.628 g/mL · 1.628 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.598(lit.)
Flammpunkt: 230 °F · >230 °F
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
Aggregatzustand: Liquid
Farbe: Clear yellow
Wichte: 1.628 · 1.628
Wasserlöslichkeit: Not miscible or difficult to mix in water.
BRN: 1422602 · 1422602
CAS Datenbank: 4214 · 4214-28-2(CAS DataBase Reference)
NIST chemische Informationen: 1 · 1-Iodo-2,4-dimethylbenzene(4214-28-2)
EPA chemische Informationen: 1 · Benzene, 1-iodo-2,4-dimethyl- (4214-28-2)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, 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 46 reports by companies from 6 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.