4-Chloro-6-hydrazinylpyrimidine

HCID 247222CAS 5767-35-1

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: NNc1cc(Cl)ncn1
InChIKey: NYXYZCSAJZLFEH-UHFFFAOYSA-N
Summenformel: C4H5ClN4
Durchschnittliche Molmasse: 144,56 g/mol
Monoisotopische Masse: 144,02027384

Namen und Bezeichner

Bevorzugter Name: 4-Chloro-6-hydrazinylpyrimidine
IUPAC: (6-chloropyrimidin-4-yl)hydrazine
Englischer Name: 4-Chloro-6-hydrazinopyrimidine
Summenformel: C4H5ClN4
Molmasse: 144.56

Namen und Synonyme

4-chloro-6-hydrazinylpyrimidineRefChem:521608814-807-84-Chloro-6-hydrazinopyrimidine5767-35-1(6-chloropyrimidin-4-yl)hydrazine4(1H)-Pyrimidinone, 6-chloro-, hydrazoneMFCD016460954-hydrazino-6-chloropyrimidineNSC61591SCHEMBL5648904-chloro-6-hydrazino-pyrimidine

Weitere Namen anzeigen

4-chloro-6-aziridinylpyrimidine(6-chloro-4-pyrimidinyl)hydrazinePyrimidine, 4-chloro-6-hydrazinyl-4-Chloro-6-hydrazinopyriMidine, 95+%4(1H)-Pyrimidinone, 6-chloro-, hydrazone (9CI)

3-Chloro-6-hydrazino-pyrimidineDTXSID002894946-chloro-4-hydrazinopyrimidine4-Chloro-6-hydrSCHEMBL300448274-chloro-6-hydrazineylpyrimidine6-chloropyrimidine-4-ylhydrazine4-Chloro-6-hydrazinopyrimidine #

Datenbank-Bezeichner

CAS: 5767-35-1
PubChem CID: 247222
DTXSID: DTXSID00289494
EC Number: 814-807-8
Nikkaji: J3.805.476G

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,7
Polarare Oberfläche (TPSA): 63,8 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 1
Schwere Atome: 9
Formalladung: 0
Komplexität: 88,6

Physikochemische Eigenschaften

Schmelzpunkt: 164 · 164-165 °C
Siedepunkt: 254.8 · 254.8±50.0 °C(Predicted)
Dichte: 1.63 · 1.63±0.1 g/cm3(Predicted)
storage temp.: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
pka: 7.29 · 7.29±0.70(Predicted)
CAS Datenbank: 5767 · 5767-35-1(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302+H312+H332 (50%): 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, 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.