2-Aminopyrimidine-4-carboxylic acid
Grundinformationen
- CAS
2164-65-0- Standard-SMILES
Nc1nccc(C(=O)O)n1- InChIKey
GKFPFLBDQJVJIH-UHFFFAOYSA-N- Summenformel
- C5H5N3O2
- Durchschnittliche Molmasse
- 139,11 g/mol
- Monoisotopische Masse
- 139,0381764
Überblick
2-Aminopyrimidine-4-carboxylic acid has been reported in Hydropuntia edulis, Lathyrus tingitanus, and other organisms with data available.
Namen und Bezeichner
- Bevorzugter Name
- 2-Aminopyrimidine-4-carboxylic acid
- IUPAC
- 2-aminopyrimidine-4-carboxylic acid
- Englischer Name
- 2-Amino-pyrimidine-4-carboxylic acid
- Summenformel
- C5H5N3O2
- Molmasse
- 139.11
Namen und Synonyme
2-Aminopyrimidine-4-carboxylic acidDTXSID10289480RefChem:85410DTXCID00240626695-963-22164-65-02-Amino-pyrimidine-4-carboxylic acidMFCD077839362-amino-4-pyrimidinecarboxylic acid4-PYRIMIDINECARBOXYLIC ACID, 2-AMINO-NSC615552-Amino-pyrimidine-4-carboxylicacid
Weitere Namen anzeigen
H-2APY4-OH4-Carboxypyrimidin-2-amine2-Amino-pyrimidine-4-carboxyL2-Aminopyrimidine-4-carboxylicaci2-azanylpyrimidine-4-carboxylic acid2-Amino-pyrimidine-4-carboxylic acid ,97%2-AMINO-PYRIMIDINE-4-CARBOXYLIC ACID USP/EP/BP4-Pyrimidinecarboxylic acid, 2-amino- (7CI,8CI,9CI)
2-Amino-4-carboxypyrimidinA18452SCHEMBL1457909GKFPFLBDQJVJIH-UHFFFAOYSA-N2-Aminopyrimidine-4-carboxylicacidNSC-61555AKOS005263917AB42844
Datenbank-Bezeichner
- CAS
2164-65-0
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -0,3
- Polarare Oberfläche (TPSA)
- 89,1 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 10
- Formalladung
- 0
- Komplexität
- 139
Physikochemische Eigenschaften
- Schmelzpunkt
- 285 °C · 285 °C
- Siedepunkt
- 474.6 · 474.6±37.0 °C(Predicted)
- Dichte
- 1.533 · 1.533±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C(protect from light)
- Aggregatzustand
- solid
- pka
- 1.55 · 1.55±0.10(Predicted)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Sicherheitsdaten
- hs_code
- 29335990
- risk_code
- 20/21/22
- safety_code
- 24/25-36/37
Chemie und Industrie
Anwendungen
Beschreibung2-Aminopyrimidine-4-carboxylic acid is a natural product found in Gracilaria edulis, Gracilaria salicornia, and other organisms with data available.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Zugehörige Reaktionen
12
Notizen zur Verbindung
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