Methyl 3-Amino-6-bromopyrazine-2-carboxylate

HCID 227251CAS 6966-01-4

Grundinformationen

Standard-SMILES
COC(=O)c1nc(Br)cnc1N
InChIKey
CNXSIRHOIFRMOB-UHFFFAOYSA-N
Summenformel
C6H6BrN3O2
Durchschnittliche Molmasse
232,03 g/mol
Monoisotopische Masse
230,96433853

Namen und Bezeichner

Bevorzugter Name
Methyl 3-Amino-6-bromopyrazine-2-carboxylate
IUPAC
methyl 3-amino-6-bromopyrazine-2-carboxylate
Englischer Name
Methyl 3-amino-6-bromopyrazine-2-carboxylate
Summenformel
C6H6BrN3O2
Molmasse
232.03

Namen und Synonyme

methyl 3-amino-6-bromopyrazine-2-carboxylateDTXSID90280793RefChem:815233DTXCID90231947687-153-26966-01-4MFCD008349642-AMINO-5-BROMOPYRAZINE-3-CARBOXYLIC ACID METHYL ESTERNSC18700Methyl 3-Amino-6-Bromopyrazine-2-Carboxylic EsterPyrazinecarboxylic acid, 3-amino-6-bromo-, methyl estermethyl 3-amino-6-bromo-2-pyrazinecarboxylate
Weitere Namen anzeigen
NSC 18700C6H6BrN3O2-6966-01-4Favipiravir Impurity 24Favipiravir Impurity 173-AMINO-6-BROMOPYRAZINE-2-CARBOXYLATEMethyl 3-amino-6-bromopyrazine-2-formate2-Amino-5-bromo-3-(methoxycarbonyl)pyrazineMethyl 6-BroMo-3-aMinopyrazine-2-carboxylate
3-AMINO-6-BROMOPYRAZINE-2-CARBOXYLIC ACID METHYL ESTERmethyl 3-amino-6-bromo-pyrazine-2-carboxylate2-amino-3-methoxycarbonyl-5-bromopyrazineEN300-1996763-Amino-6-bromo-pyrazine-2-carboxylic acid methyl esterMethyl3-amino-6-bromopyrazine-2-carboxylateAM20070383methyl 6-bromo-3-amino-2-pyrazinecarboxylate

Datenbank-Bezeichner

CAS
6966-01-4
PubChem CID
227251
DTXSID
DTXSID90280793
EC Number
687-153-2
Nikkaji
J384.897C

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,2
Polarare Oberfläche (TPSA)
78,1 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
5
Frei drehbare Bindungen
2
Schwere Atome
12

Physikochemische Eigenschaften

Schmelzpunkt
164 · 164-166C
Siedepunkt
322.4 · 322.4±37.0 °C(Predicted)
Dichte
1.754 · 1.754±0.06 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
Löslichkeit
soluble in Chloroform, Ethyl Acetate, Methanol
pka
-1.74 · -1.74±0.10(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H317 (93%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 4 notifications to the ECHA C&L Inventory.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Sens. 1 (93%)

Sicherheitsdaten

wgk
WGK 3
hs_code
2933998090
risk_code
43
hazard_code
Xi
safety_code
37
Speicherklasse
11 - Combustible Solids

Chemie und Industrie

Anwendungen

VerwendenPyrazine derivatives as Axl and C-Met receptor enzyme inhibitors.

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