2-Amino-2-cyanacetamid
2-Amino-2-cyanoacetamide
Grundinformationen
- CAS
6719-21-7- Standard-SMILES
N#CC(N)C(N)=O- InChIKey
JRWAUKYINYWSTA-UHFFFAOYSA-N- Summenformel
- C3H5N3O
- Durchschnittliche Molmasse
- 99,09 g/mol
- Monoisotopische Masse
- 99,04326179
Namen und Bezeichner
- Bevorzugter Name
- 2-Amino-2-cyanoacetamide
- IUPAC
- 2-amino-2-cyanoacetamide
- Lokaler Name
- 2-Amino-2-cyanacetamid
- Englischer Name
- 2-Amino-2-cyanoacetamide
- Summenformel
- C3H5N3O
- Molmasse
- 99.09
Namen und Synonyme
2-Amino-2-cyanoacetamide6719-21-7AminocyanoacetamideAcetamide, 2-amino-2-cyano-2-AminocyanoacetamideAminocyanacetamidea-Amino-a-cyanoacetamideEINECS 229-771-3NSC 108868RefChem:85068229-771-3JRWAUKYINYWSTA-UHFFFAOYSA-N
Weitere Namen anzeigen
ACATIMTEC-BB SBB0015012-Amino-2-cyanacetamid2-cyano-2-aminoacetamide2-Amino-2-cyanoacetamide 97%
MFCD000405323-nitriloalaninamideAmino(carbamoyl)acetonitrile(S)-2-Amino-2-cyanoacetamide2091785-71-43nitriloalaninamideNSC1088682-amino-cyanoacetamide
Datenbank-Bezeichner
- CAS
6719-21-7- PubChem CID
- 98341
- DTXSID
DTXSID101313188- EC Number
- 229-771-3
- Nikkaji
- J298.081I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -1,8
- Polarare Oberfläche (TPSA)
- 92,9 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 121
Physikochemische Eigenschaften
- Schmelzpunkt
- 120 · 120-124 °C
- Siedepunkt
- 338.5 · 338.5±37.0 °C(Predicted)
- Dichte
- 1.298 · 1.298±0.06 g/cm3(Predicted)
- storage temp.
- 20 °C · Store at <= 20°C.
- Aggregatzustand
- Powder
- pka
- 17.05 · 17.05±0.50(Predicted)
- Farbe
- Beige to tan
- Wasserlöslichkeit
- soluble
- InChI
- InChI=1S/C3H5N3O/c4-1-2(5)3(6)7/h2H,5H2,(H2,6,7)
- InChIKey
- JRWAUKYINYWSTA-UHFFFAOYSA-N
- SMILES
- C(N)(=O)C(N)C#N
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Warning
H302+H312+H332 (88.4%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, 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.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (88.4%)
Sicherheitsdaten
- wgk
- WGK 1 slightly water endangering
- hs_code
- 2926 90 70
- risk_code
- 34-23-51-36-22
- Toxizität
- LD50 orally in Rabbit: > 2000 mg/kg
- hazard_code
- T,Xi,Xn
- hazard_note
- Irritant
- safety_code
- 45-36/37/39-26
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Acute Tox. 4 DermalAcute Tox. 4 InhalationAquatic Chronic 2Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Beschreibung2-Amino-2-cyanoacetamide, a purine derivative with a diatomic molecule, has been shown to inhibit cancer cells in animals. It has been shown to inhibit the replication of plague virus, an RNA virus that causes encephalitis and other diseases in humans. The nitrogen atom on the molecule is responsible for its transport properties, including intestinal uptake and the ability to cross the blood-brain barrier.2-Amino-2-cyanoacetamide also inhibits the activity of amide hydrolase, an enzyme responsible for the hydrolysis of peptides into amino acids. This process results in reduced protein synthesis, which leads to cell death.
Verwenden2-Amino-2-cyanoacetamide is used as building block in chemical synthesis. Attributes Development Product Contact
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Zugehörige Reaktionen
25
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