1-Benzyl-4-iodobenzene

HCID 2759364

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Grundinformationen

CAS: 35444-94-1
Standard-SMILES: Ic1ccc(Cc2ccccc2)cc1
InChIKey: FCUNNMLRHRWXAM-UHFFFAOYSA-N
Summenformel: C13H11I
Durchschnittliche Molmasse: 294,13 g/mol
Monoisotopische Masse: 293,99055

Namen und Bezeichner

Bevorzugter Name: 1-Benzyl-4-iodobenzene
IUPAC: 1-benzyl-4-iodobenzene
Englischer Name: 4-Iododiphenylmethane
Summenformel: C13H11I
Molmasse: 294.13

Namen und Synonyme

1-benzyl-4-iodobenzeneRefChem:429939674-183-64-Iododiphenylmethane35444-94-11-benzyl-4-iodo-benzeneMFCD002701114-benzyliodobenzenep-iododiphenylmethaneBenzene, 1-iodo-4-(phenylmethyl)-SCHEMBL4511SCHEMBL4390802

Weitere Namen anzeigen

SCHEMBL4390804SCHEMBL27739505DTXSID90374762FCUNNMLRHRWXAM-UHFFFAOYSA-NKBA44494AKOS025310003FS-4898EN300-3536285

Datenbank-Bezeichner

CAS: 35444-94-1
PubChem CID: 2759364
DTXSID: DTXSID90374762
EC Number: 674-183-6
Nikkaji: J1.461.860K

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 4,8
Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 0
Frei drehbare Bindungen: 2
Schwere Atome: 14
Formalladung: 0
Komplexität: 153

Physikochemische Eigenschaften

Schmelzpunkt: 38 °C · 38 °C
Siedepunkt: 151 · 151-152 °C(Press: 1 Torr)
Dichte: 1.54 · 1.540±0.06 g/cm3(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 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.