4-Hydrazinopyrimidine

HCID 12228554CAS 22930-71-8

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Grundinformationen

Standard-SMILES: NNc1ccncn1
InChIKey: QIEQDFYXVYQLLU-UHFFFAOYSA-N
Summenformel: C4H6N4
Durchschnittliche Molmasse: 110,12 g/mol
Monoisotopische Masse: 110,05924621

Namen und Bezeichner

Bevorzugter Name: 4-Hydrazinopyrimidine
IUPAC: pyrimidin-4-ylhydrazine
Englischer Name: 4(1H)-Pyrimidinone, hydrazone (9CI)
Summenformel: C4H6N4
Molmasse: 110.12

Namen und Synonyme

4-hydrazinopyrimidine22930-71-8RefChem:523628818-578-54-Hydrazinylpyrimidinepyrimidin-4-ylhydrazineMFCD098632544(1H)-Pyrimidinone, hydrazone4(1H)-Pyrimidinone, hydrazone (9CI)SCHEMBL2086404AKOS010502648SB55547

Weitere Namen anzeigen

Pyrimidin-4-yl-hydrazinePyrimidine, 4-hydrazinyl-4-1H-PYRIMIDINONE,HYDRAZONE4-hydrazinylpyrimidine - [H85402]

4-hydrazineylpyrimidine(Z)-4-hydrazono-1,4-dihydropyri(Z)-4-hydrazono-1,4-dihydropyrimidineAS-75589SY185630DB-349258CS-0106397EN300-80992

Datenbank-Bezeichner

CAS: 22930-71-8
PubChem CID: 12228554
EC Number: 818-578-5

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -0,2
Polarare Oberfläche (TPSA): 63,8 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 1
Schwere Atome: 8
Formalladung: 0
Komplexität: 65

Physikochemische Eigenschaften

Schmelzpunkt: 132 · 132-134 °C (decomp)
Siedepunkt: 246.3 · 246.3±23.0 °C(Predicted)
Dichte: 1.39 · 1.39±0.1 g/cm3(Predicted)
storage temp.: -20 °C · Storage temp. -20°C
pka: 8 · 8.00±0.70(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；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]；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, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 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.