Di(succinimido)carbonat

Di(succinimido) carbonate

HCID 676246CAS 74124-79-1

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Grundinformationen

Standard-SMILES: O=C(ON1C(=O)CCC1=O)ON1C(=O)CCC1=O
InChIKey: PFYXSUNOLOJMDX-UHFFFAOYSA-N
Summenformel: C9H8N2O7
Durchschnittliche Molmasse: 256,17 g/mol
Monoisotopische Masse: 256,0331506

Namen und Bezeichner

Bevorzugter Name: Di(succinimido) carbonate
IUPAC: bis(2,5-dioxopyrrolidin-1-yl) carbonate
Lokaler Name: Di(succinimido)carbonat
Englischer Name: N,N'-Disuccinimidyl carbonate
Summenformel: C9H8N2O7
Molmasse: 256.17

Namen und Synonyme

74124-79-1Di(succinimido) carbonatedisuccinimidyl carbonateEINECS 277-730-32,5-Pyrrolidinedione, 1,1'-[carbonylbis(oxy)]bis-EC 277-730-3DTXSID102250802,5-Pyrrolidinedione, 1,1'-(carbonylbis(oxy))bis-RefChem:585965DTXCID10147571277-730-3N,N'-Disuccinimidyl carbonate

Weitere Namen anzeigen

SU2ON'-Disuccinimidyl carbonateBIS(N-SUCCINIMIDYL) CARBONATECarbonic acid bis-(2,5-dioxo-pyrrolidin-1-yl) ester(SUO)2CO

bis(2,5-dioxopyrrolidin-1-yl) carbonaten,n'-disuccinimidylcarbonateDi(N-succinimidyl) carbonateC9H8N2O7MFCD00009767DSCN-Succinimidyl carbonateN,N'-Disuccinimidyl carbonate (DSC)

Datenbank-Bezeichner

CAS: 74124-79-1
PubChem CID: 676246
DTXSID: DTXSID10225080
UNII: WDP42UC5P4
EC Number: 277-730-3
Nikkaji: J208.393K

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -1,3
Polarare Oberfläche (TPSA): 110 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 7
Frei drehbare Bindungen: 4
Schwere Atome: 18
Formalladung: 0
Komplexität: 386

Physikochemische Eigenschaften

Schmelzpunkt: 190 °C · 190 °C (dec.)(lit.)
Siedepunkt: 399.41 °C · 399.41°C (rough estimate)
Dichte: 1.567 · 1.5670 (rough estimate)
Brechungsindex: 1.56 · 1.5600 (estimate)
storage temp.: -20 °C · -20°C
Löslichkeit: Dichloromethane (Slightly, Heated), DMSO
Aggregatzustand: Crystalline Powder
Farbe: White to slightly yellow
Wasserlöslichkeit: Soluble in dimethyl sulfoxide, hot pyridine, acetonitrile and most organic solvents. Insoluble in water.
BRN: 1499137 · 1499137
Stabilität: Moisture Sensitive
Major Application: peptide synthesis
InChI: InChI=1S/C9H8N2O7/c12-5-1-2-6(13)10(5)17-9(16)18-11-7(14)3-4-8(11)15/h1-4H2
InChIKey: PFYXSUNOLOJMDX-UHFFFAOYSA-N
SMILES: C(ON1C(=O)CCC1=O)(=O)ON1C(=O)CCC1=O
CAS Datenbank: 74124 · 74124-79-1(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H301 (34.5%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, 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 113 reports by companies from 20 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: 2,5-Pyrrolidinedione, 1,1'-[carbonylbis(oxy)]bis-

Status: Active Update: 29-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26301

Hazard Classes and CategoriesAcute Tox. 3 (34.5%)

Sicherheitsdaten

F: 10-21
wgk: 3
tsca: No
hs_code: 29299000
risk_code: 22-36/37/38
hazard_code: Xn,Xi
safety_code: 26-37/39-36
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2STOT RE 2 Oral

Chemie und Industrie

Anwendungen · 1 Eintrag

VerwendenN,N'-Disuccinimidyl carbonate is used to prepare cleavable linker succinimide vinylsufonylethyl carbonate for thiol modified-DNA. It serves as a reagent for the synthesis of carbamates. Further, it is used as a coupling reagent as well as in the preparation of N-succinimidyl esters of N-protected amino acids, activated carbonate and coupling of ligand to proteins.