CAS 1086382-78-6 2-Bromo-5-cyclopropylpyrazine (HCID 45787635)

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Basic information

CAS: 1086382-78-6
Standard SMILES: Brc1cnc(C2CC2)cn1
InChIKey: XYUKBHLOJYSASH-UHFFFAOYSA-N
Molecular formula: C7H7BrN2
Average molar mass: 199.05 g/mol
Monoisotopic mass: 197.97926032

Names & identifiers

Preferred name: 2-Bromo-5-cyclopropylpyrazine
IUPAC: 2-bromo-5-cyclopropylpyrazine
English name: 2-BroMo-5-cyclopropylpyrazine
Molecular formula: C7H7BrN2
Molecular weight: 199.05

Names & synonyms

2-BROMO-5-CYCLOPROPYLPYRAZINE1086382-78-6DTXSID50671683RefChem:85760DTXCID90622432958-137-52-Bromo-5-cyclopropyl-pyrazineMFCD11223431SCHEMBL9966891AKOS006308528AS-41740SY258524

Show more names

Pyrazine, 2-bromo-5-cyclopropyl-

EN300-698801Z11983193062-Bromo-5-(cyclopropyl)pyrazineBCP32706A895224SCHEMBL29441632XYUKBHLOJYSASH-UHFFFAOYSA-NCS-D0132

Database identifiers

CAS: 1086382-78-6
PubChem CID: 45787635
DTXSID: DTXSID50671683
EC Number: 958-137-5

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 25.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 125

Physicochemical properties

storage temp.: 2 · 2-8°C
Appearance: White to off-white Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.