CAS 14559-88-7 2,2-Dimethylethenylboronic acid (HCID 2763299)

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Grundinformationen

CAS: 14559-88-7
Standard-SMILES: CC(C)=CB(O)O
InChIKey: FWJRSOGVYOIVOC-UHFFFAOYSA-N
Summenformel: C4H9BO2
Durchschnittliche Molmasse: 99,93 g/mol
Monoisotopische Masse: 100,0695597

Namen und Bezeichner

Bevorzugter Name: 2,2-Dimethylethenylboronic acid
IUPAC: 2-methylprop-1-enylboronic acid
Englischer Name: 2,2-DIMETHYLETHENYLBORONIC ACID
Summenformel: C4H9BO2
Molmasse: 99.92

Namen und Synonyme

2,2-Dimethylethenylboronic acid14559-88-7DTXSID70376880RefChem:243571DTXCID20327908(2-METHYLPROP-1-EN-1-YL)BORONIC ACID2-methylprop-1-enylboronic AcidMFCD010746092-methyl-1-propenylboronic acid(2,2-Dimethylethenyl)boronic acidBoronic acid, B-(2-methyl-1-propen-1-yl)-(2-methyl-1-propen-1-yl)boronic acid

Weitere Namen anzeigen

ethenyLRARECHEM AH PB 0256(2-Methyl-1-propen-1-yl)boronicacid2,2-DIMETHYLETHENYLBORONIC ACID 97%B-(2-methyl-1-propen-1-yl)boronic acid2,2-Dimethylethenylboronic acid - [D3007]2,2-Dimethylethenylboronic acid（contains varying amounts of Anhydride）

2-methyl-1-propen-1-yl-boronic acidAS-64835EN300-260122Boronic acid, (2-methyl-1-propenyl)-2,2-dimethylethenylboronicacidAMY021Boronic acid,B-(2-methyl-1-propen-1-yl)-2,2-Dimethyl ethenylboronic acid

Datenbank-Bezeichner

CAS: 14559-88-7
PubChem CID: 2763299
DTXSID: DTXSID70376880
EC Number: 672-920-6
Nikkaji: J2.994.272B

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 40,5 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 7
Formalladung: 0
Komplexität: 73

Physikochemische Eigenschaften

Schmelzpunkt: 87 °C · 87 °C
Siedepunkt: 190.6 · 190.6±23.0 °C(Predicted)
Dichte: 0.952 · 0.952±0.06 g/cm3(Predicted)
storage temp.: -20 °C · Inert atmosphere,Store in freezer, under -20°C
Aggregatzustand: solid
pka: 9.82 · 9.82±0.43(Predicted)
Farbe: White to off-white

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.