3-Isopropoxy-4-(tri-n-butylstannyl)-3-cyclobutene-1,2-dione

HCID 2736683CAS 129034-70-4

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Grundinformationen

Standard-SMILES: CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1c(OC(C)C)c(=O)c1=O
InChIKey: AMVLEBHYELFWJT-UHFFFAOYSA-N
Summenformel: C19H34O3Sn
Durchschnittliche Molmasse: 429,2 g/mol
Monoisotopische Masse: 430,152997

Namen und Bezeichner

Bevorzugter Name: 3-Isopropoxy-4-(tri-n-butylstannyl)-3-cyclobutene-1,2-dione
IUPAC: 3-propan-2-yloxy-4-tributylstannylcyclobut-3-ene-1,2-dione
Englischer Name: 3-Isopropoxy-4-(tributylstannyl)-1,2-cyclobutenedioneLiebeskind Reagent
Summenformel: C19H34O3Sn
Molmasse: 429.18

Namen und Synonyme

3-isopropoxy-4-(tri-n-butylstannyl)-3-cyclobutene-1,2-dioneRefChem:502840677-926-2129034-70-43-Isopropoxy-4-(tributylstannyl)-1,2-cyclobutenedione3-Cyclobutene-1,2-dione, 3-(1-methylethoxy)-4-(tributylstannyl)-3-propan-2-yloxy-4-tributylstannylcyclobut-3-ene-1,2-dione3-(propan-2-yloxy)-4-(tributylstannyl)cyclobut-3-ene-1,2-dione3-Isopropoxy-4-tributylstannyl-1,2-cyclobutenedione3-Isopropoxy-4-(tributylstannyl)-1,2-cyclobutenedioneLiebeskind ReagentAMVLEBHYELFWJT-UHFFFAOYSA-NSCHEMBL2210513

Weitere Namen anzeigen

SKL9913-Isopropoxy-4-(tributylstannyl)-12-cyclobutenedioneLiebeskind Reagent3-Isopropoxy-4-(tributylstannyl)cyclobut-3-ene-1,2-dione3-Isopropoxy-4-(tributylstannyl)-1,2-cyclobutenedione - I28553-(1-Methylethoxy)-4-(tributylstannyl)-3-cyclobutene-1,2-dione3-Isopropoxy-4-(tri-n-butylstannyl)-3-cyclobutene-1,2-dione,97%3-Isopropoxy-4-(tri-n-butylstannyl)-3-cyclobutene-1,2-dione, 97%4-(1-methylethoxy)-3-(tri-n-butylstannyl)cyclobut-3-ene-1,2-dione

DTXSID60371526AKOS015838532AS-71821DS-0011893-isopropoxy-4-tributylstannylcyclobut-3-ene-1,2-dione3-(Tri-n-butylstannyl)-4-isopropoxy-3-cyclobutene-1,2-dione3-isopropoxy-4-(tri-n-butyl-stannyl)-3-cyclobutene-1,2-dione3-(1-methylethoxy)-4-(tri-n-butylstannyl)-3-cyclobutene-1,2-dione

Datenbank-Bezeichner

CAS: 129034-70-4
PubChem CID: 2736683
DTXSID: DTXSID60371526
EC Number: 677-926-2
Nikkaji: J337.507B

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 43,4 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 12
Schwere Atome: 23
Formalladung: 0
Komplexität: 430

Physikochemische Eigenschaften

Siedepunkt: 425.2 · 425.2±55.0 °C(Predicted)
Wasserlöslichkeit: Sparingly soluble in water.

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H360FD (87.5%): May damage fertility; May damage the unborn child [Danger Reproductive toxicity]；H372 (100%): Causes damage to organs through prolonged or repeated exposure [Danger Specific target organ toxicity, repeated exposure]；H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P203, P260, P264, P264+P265, P270, P273, P280, P301+P316, P302+P352, P305+P351+P338, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 32 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.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 3 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Repr. 1B (87.5%)；STOT RE 1 (100%)；Aquatic Acute 1 (100%)；Aquatic Chronic 1 (100%)