Grundinformationen
- Standard-SMILES
O=CN1CCN(C=O)CC1- InChIKey
CBLGQEBXWDKYDI-UHFFFAOYSA-N- Summenformel
- C6H10N2O2
- Durchschnittliche Molmasse
- 142,16 g/mol
- Monoisotopische Masse
- 142,07422756
Namen und Bezeichner
- Bevorzugter Name
- 1,4-Piperazinedicarboxaldehyde
- IUPAC
- piperazine-1,4-dicarbaldehyde
- Lokaler Name
- Piperazin-1,4-dicarbaldehyd
- Englischer Name
- 1,4-Diformylpiperazine
- Summenformel
- C6H10N2O2
- Molmasse
- 142.16
Namen und Synonyme
4164-39-0Piperazine-1,4-dicarbaldehyde1,4-PiperazinedicarboxaldehydeEINECS 224-011-7AI3-28699NSC 506922DTXSID4063329RefChem:417026DTXCID2039960224-011-71,4-DiformylpiperazineMFCD00006153
Weitere Namen anzeigen
1,4-PIPERAZINE DIALDEHYDE1,4-Diformylpiperazine, 98+%piperazine-1,4-dicarboxaldehyde1,4-Piperazinedicarboxaldehyde 98%1,4-Piperazinedicarboxaldehyde,98%TIANFUCHEM--4164-39-0--1,4-DIFORMYLPIPERAZINE in stock
1,4-Piperazinedicarbaldehyde14-DIFORMYLPIPERAZINESCHEMBL141255AKOS002305714D2578D82908NSC506922FT-0606872
Datenbank-Bezeichner
- CAS
4164-39-0- PubChem CID
- 77821
- DTXSID
DTXSID4063329- EC Number
- 224-011-7
- Nikkaji
- J224.964B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -1
- Polarare Oberfläche (TPSA)
- 40,6 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 114
Physikochemische Eigenschaften
- Schmelzpunkt
- 126 · 126-129 °C(lit.)
- Siedepunkt
- 154 °C · 154°C 0,25mm
- Dichte
- 1.2298 · 1.2298 (rough estimate)
- Brechungsindex
- 1.501 · 1.5010 (estimate)
- Flammpunkt
- 154 °C/0.25mm · 154°C/0.25mm
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Aggregatzustand
- powder to crystal
- pka
- 1.26 · 1.26±0.70(Predicted)
- Farbe
- White to Light yellow
- BRN
- 121175 · 121175
- InChI
- 1S/C6H10N2O2/c9-5-7-1-2-8(6-10)4-3-7/h5-6H,1-4H2
- InChIKey
- CBLGQEBXWDKYDI-UHFFFAOYSA-N
- SMILES
- O=CN1CCN(CC1)C=O
- CAS Datenbank
- 4164 · 4164-39-0(CAS DataBase Reference)
- EPA chemische Informationen
- 1 · 1,4-Piperazinedicarboxaldehyde (4164-39-0)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 96.3% (104 of 108) of all reports.
Not Classified
Aggregated GHS information provided per 108 reports by companies from 2 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesNot Classified
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29335990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 24/25-36/37-26
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information1,4-Piperazinedicarboxaldehyde: ACTIVE
Anwendungen
Verwenden1,4-Piperazinedicarboxaldehyde may be used in chemical synthesis studies.
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