3-(3-Bromophenyl)cyclobutan-1-one

HCID 17750101

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Grundinformationen

CAS: 885267-15-2
Standard-SMILES: O=C1CC(c2cccc(Br)c2)C1
InChIKey: RLKCJCIUTBLVRJ-UHFFFAOYSA-N
Summenformel: C10H9BrO
Durchschnittliche Molmasse: 225,08 g/mol
Monoisotopische Masse: 223,98368

Namen und Bezeichner

Bevorzugter Name: 3-(3-Bromophenyl)cyclobutan-1-one
IUPAC: 3-(3-bromophenyl)cyclobutan-1-one
Englischer Name: 3-(3-Bromophenyl)cyclobutanone
Summenformel: C10H9BrO
Molmasse: 225.08

Namen und Synonyme

885267-15-23-(3-bromophenyl)cyclobutan-1-oneDTXSID80590252RefChem:274107DTXCID70541016828-712-43-(3-BROMOPHENYL)CYCLOBUTANONEMFCD087063403-(3-Bromophenyl)-cyclobutanoneSCHEMBL2795677RLKCJCIUTBLVRJ-UHFFFAOYSA-N3-(3-bromo-phenyl)-cyclobutanone

Weitere Namen anzeigen

Cyclobutanone, 3-(3-bromophenyl)-

AKOS015918054AS-43618SY174507DB-077330CS-0060392EN300-43637F603214F8881-7559

Datenbank-Bezeichner

CAS: 885267-15-2
PubChem CID: 17750101
DTXSID: DTXSID80590252
EC Number: 828-712-4

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,1
Polarare Oberfläche (TPSA): 17,1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 1
Schwere Atome: 12
Formalladung: 0
Komplexität: 182

Physikochemische Eigenschaften

Siedepunkt: 307.4 · 307.4±42.0 °C(Predicted)
Dichte: 1.522 · 1.522±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): 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 2 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.