Sodium Diformylamide

HCID 10877056

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Grundinformationen

CAS: 18197-26-7
Standard-SMILES: O=C[N-]C=O.[Na+]
InChIKey: QJXDSDLNUKLDBP-UHFFFAOYSA-M
Summenformel: C2H2NNaO2
Durchschnittliche Molmasse: 95,03 g/mol
Monoisotopische Masse: 94,99832259

Namen und Bezeichner

Bevorzugter Name: Sodium Diformylamide
IUPAC: sodium diformylazanide
Englischer Name: DIFORMYLIMIDE SODIUM SALT
Summenformel: C2H2NNaO2
Molmasse: 95.03255

Namen und Synonyme

Sodium diformylamideDTXSID50446676RefChem:380721DTXCID50397497629-644-618197-26-7Diformylimide sodium saltsodium;diformylazanideSodium DiformylazanideDiformylamide Sodium Saltsodium diformamide(DIFORMYLAMINO)SODIUM

Weitere Namen anzeigen

Sodium N-formylimidoformatediformylazanideDiformylimide sodiumSodium dimethylaminoNatriumdiformylazanidSodium diformamide,98%

MFCD00145302sodium,diformylazanideC2H2NNaO2DiformylsodiumDiformylamide sodiumSCHEMBL165594Sodium N-formyl(oxo)methanaminideDiformylimide sodium salt, tech grade

Datenbank-Bezeichner

CAS: 18197-26-7
PubChem CID: 10877056
DTXSID: DTXSID50446676
EC Number: 629-644-6

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 35,1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 0
Schwere Atome: 6
Formalladung: 0
Komplexität: 40

Physikochemische Eigenschaften

Schmelzpunkt: 205 °C · 205°C
Flammpunkt: 78.9 ℃ · 78.9℃
storage temp.: 2 · Inert atmosphere,2-8°C
Wasserlöslichkeit: Soluble in water
Aggregatzustand: Powder
Farbe: Slightly beige
BRN: 3567185 · 3567185
InChI: InChI=1S/C2H3NO2.Na/c4-1-3-2-5;/h1-2H,(H,3,4,5);/q;+1/p-1
InChIKey: QJXDSDLNUKLDBP-UHFFFAOYSA-M
SMILES: [Na+].[N-](C=O)C=O
CAS Datenbank: 18197 · 18197-26-7(CAS DataBase Reference)

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 (97.7%): 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 43 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.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.7%)

Sicherheitsdaten

F: 3-9-34
wgk: 3
hs_code: 29251900
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Anwendungen · 1 Eintrag

VerwendenReactant for preparation of:Functionalized condensed benzazolesα-ketoheterocycles as inhibitors of Leishmania mexicana cysteine protease CPBINOS inhibitor PHA-399733 via Bucherer-Bergs hydantoin synthesisAntibiotic resistance (C β-lactamase AmpC ) inhibitor analogues, with improved cell permeability propertiesBINOL- and H8-BINOL-based aryl phosphites as ligands in palladium-catalyzed asymmetric allylation and amination reactionsPrecursors of αVβ3 integrin antagonists