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2-Chloro-5-(1-ethoxyethenyl)pyrazine

HCID 59283000
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C=C(OCC)c1cnc(Cl)cn1
InChIKey
IGAFBKBEQUKPME-UHFFFAOYSA-N
Molecular formula
C8H9ClN2O
Average molar mass
184.62 g/mol
Monoisotopic mass
184.0403406

Names & identifiers

Preferred name
2-Chloro-5-(1-ethoxyethenyl)pyrazine
IUPAC
2-chloro-5-(1-ethoxyethenyl)pyrazine

Names & synonyms

2-chloro-5-(1-ethoxyethenyl)pyrazine1206723-31-0SCHEMBL3302582GYB72331EN300-768768Z2939728968

Database identifiers

PubChem CID
59283000

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
35 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
163

Related reactions

2 records
New reaction record
HRID 119074 reaction equation
HRID 119074As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 317802 reaction equation
HRID 317802As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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