2,4-Diaminopyrimidine-5-carbonitrile

HCID 282115CAS 16462-27-4

Grundinformationen

Standard-SMILES
N#Cc1cnc(N)nc1N
InChIKey
OYUQCQCQLDTRHQ-UHFFFAOYSA-N
Summenformel
C5H5N5
Durchschnittliche Molmasse
135,13 g/mol
Monoisotopische Masse
135,05449518

Namen und Bezeichner

Bevorzugter Name
2,4-Diaminopyrimidine-5-carbonitrile
IUPAC
2,4-diaminopyrimidine-5-carbonitrile
Englischer Name
2,4-Diaminopyrimidine-5-carbonitrile
Summenformel
C5H5N5
Molmasse
135.13

Namen und Synonyme

2,4-Diaminopyrimidine-5-carbonitrile16462-27-4DTXSID60300179RefChem:82285DTXCID60251314813-877-72,4-Diamino-5-cyanopyrimidine2,4-Diamino-pyrimidine-5-carbonitrileMFCD000856005-Pyrimidinecarbonitrile, 2,4-diamino-NSC 1352352,4-diamino-5-pyrimidine carbonitrile
Weitere Namen anzeigen
2,4-DIAMINO-5-CYANO-PYRIMIDINE2,4-Diaminopyrimidine-5-carbonitriL2,4-Diaminopyrimidine-5-carbonitrile ,97%5-Pyrimidinecarbonitrile, 2,4-diamino- (6CI,8CI,9CI)2,4-DIAMINOPYRIMIDINE-5-CARBONITRILE ISO 9001:2015 REACH
2,4-Diamino-5-cyanopyrimidine; 2,4-Diamino-5-pyrimidinecarbonitrile; NSC 135235;2,4-diamino-5-pyrimidinecarbonitrileNSC135235SCHEMBL263835SCHEMBL17330922pyrimidine, 2,4-diamino-5-cyano-SBB012809STK785133

Datenbank-Bezeichner

CAS
16462-27-4
PubChem CID
282115
DTXSID
DTXSID60300179
EC Number
813-877-7

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,2
Polarare Oberfläche (TPSA)
102 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
5
Frei drehbare Bindungen
0
Schwere Atome
10

Physikochemische Eigenschaften

Schmelzpunkt
318 °C · 318 °C (decomp)
Siedepunkt
498.2 · 498.2±55.0 °C(Predicted)
Dichte
1.45 · 1.45±0.1 g/cm3(Predicted)
storage temp.
2 · Keep in dark place,Sealed in dry,2-8°C
Löslichkeit
DMF (Slightly, Heated), DMSO (Slightly)
Aggregatzustand
Solid

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral];H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral];H311 (50%): Toxic in contact with skin [Danger Acute toxicity, dermal];H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H331 (50%): Toxic if inhaled [Danger Acute toxicity, inhalation];H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 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 CategoriesAcute Tox. 3 (50%);Acute Tox. 4 (50%);Acute Tox. 3 (50%);Acute Tox. 4 (50%);Skin Irrit. 2 (100%);Eye Irrit. 2A (100%);Acute Tox. 3 (50%);Acute Tox. 4 (50%);STOT SE 3 (100%)

Sicherheitsdaten

hs_code
29335990

Chemie und Industrie

Anwendungen

Verwenden2,4-Diaminopyrimidine-5-carbonitrile is used as an intermediate for the preparation of medicines and agrochemicals (1).

Anbieter50 Anbieter

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海策嵘生物科技有限公司[email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海皓竹医药科技有限公司18912729622 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]

Zugehörige Reaktionen

4

Verknüpfte Notizen

Wird geladen…