3-Hydrazinyl-6-phenylpyridazine

HCID 6409842CAS 38956-80-8

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: NNc1ccc(-c2ccccc2)nn1
InChIKey: ZNGXOKMCRDQBON-UHFFFAOYSA-N
Summenformel: C10H10N4
Durchschnittliche Molmasse: 186,21 g/mol
Monoisotopische Masse: 186,09054634

Namen und Bezeichner

Bevorzugter Name: 3-Hydrazinyl-6-phenylpyridazine
IUPAC: (6-phenylpyridazin-3-yl)hydrazine
Englischer Name: 3-hydrazino-6-phenylpyridazine
Summenformel: C10H10N4
Molmasse: 186.21

Namen und Synonyme

38956-80-83-Hydrazinyl-6-phenylpyridazineRefChem:502250822-631-83-hydrazino-6-phenylpyridazine(6-phenylpyridazin-3-yl)hydrazineMFCD01219682pyridazine, 3-hydrazino-6-phenyl-SCHEMBL1752770CHEMBL3764140DTXSID50423366ZNGXOKMCRDQBON-UHFFFAOYSA-N

Weitere Namen anzeigen

(6-phenyl-3-pyridazinyl)hydrazinePyridazine, 3-hydrazinyl-6-phenyl-6-hydrazono-3-phenyl-1,6-dihydropyridazine3-hydrazino-6-phenylpyridazine(SALTDATA: FREE)3-hydrazino-6-phenylpyridazine(SALTDATA: FREE) ISO 9001：2015 REACH

ALBB-0145411(6-phenylpyridazin-3-yl)hydrazineSTL5730041-(6-phenylpyridazin-3-yl)hydrazineAKOS000266308BS-3640DA-183953-Hydrazino-6-phenylpyridazine, AldrichCPR

Datenbank-Bezeichner

CAS: 38956-80-8
PubChem CID: 6409842
DTXSID: DTXSID50423366
ChEMBL: CHEMBL3764140
EC Number: 822-631-8
Nikkaji: J868.731E

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,4
Polarare Oberfläche (TPSA): 63,8 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 2
Schwere Atome: 14
Formalladung: 0
Komplexität: 168

Physikochemische Eigenschaften

Schmelzpunkt: 144 °C · 144 °C
Siedepunkt: 350.2 · 350.2±25.0 °C(Predicted)
Dichte: 1.26 · 1.26±0.1 g/cm3(Predicted)
pka: 5.94 · 5.94±0.20(Predicted)
Aggregatzustand: solid
InChI: 1S/C10H10N4/c11-12-10-7-6-9(13-14-10)8-4-2-1-3-5-8/h1-7H,11H2,(H,12,14)
InChIKey: ZNGXOKMCRDQBON-UHFFFAOYSA-N
SMILES: NNC1=NN=C(C2=CC=CC=C2)C=C1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H351 (100%): Suspected of causing cancer [Warning Carcinogenicity]

P203, P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P318, P330, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Eye Dam. 1 (100%)；Carc. 2 (100%)

Sicherheitsdaten

wgk: 3
ridadr: UN 2811 6.1 / PGIII
risk_code: 25
hazard_code: T
safety_code: 45
Speicherklasse: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard Classifications: Acute Tox. 3 Oral