2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine

C12H8ClFN2O — CID 174161630

IUPAC2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine
SMILESC=Cc1cncc(Oc2ccc(Cl)cc2F)n1
InChIInChI=1S/C12H8ClFN2O/c1-2-9-6-15-7-12(16-9)17-11-4-3-8(13)5-10(11)14/h2-7H,1H2
InChIKeySIULUGFAEXCCHT-UHFFFAOYSA-N
MW250.66 g/mol
LogP3.70
Rot. Bonds3

About 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine

2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine (PubChem CID 174161630) has the molecular formula C12H8ClFN2O and a molecular weight of 250.66 g/mol. Its IUPAC name is 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine.

Molecular Properties

Compound Name2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine
PubChem CID174161630
Molecular FormulaC12H8ClFN2O
Molecular Weight250.66 g/mol
Exact Mass250.03
IUPAC Name2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine
SMILESC=Cc1cncc(Oc2ccc(Cl)cc2F)n1
InChIInChI=1S/C12H8ClFN2O/c1-2-9-6-15-7-12(16-9)17-11-4-3-8(13)5-10(11)14/h2-7H,1H2
InChIKeySIULUGFAEXCCHT-UHFFFAOYSA-N
XLogP3.70
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.66
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-1-(4-chloro-2-fluorophenoxy)-2-fluorobenzene
CID 142784638
2-(chloromethyl)-6-(4-chloro-2-methylphenoxy)pyrazine
CID 66466430
2-(4-chloro-2-fluorophenoxy)-5-(methylsulfanyloxymethyl)pyrazine
CID 146526939
6-(4-bromo-2-fluorophenoxy)-N-methylpyrazin-2-amine
CID 80881350
(1S)-1-[6-(4-chloro-2-fluorophenoxy)-3-pyridinyl]ethanamine
CID 174273133
[6-(2,5-dichlorophenoxy)pyrazin-2-yl]methanamine
CID 66451005
6-(4-chloro-2-fluorophenoxy)pyridazine-3-carbonitrile
CID 133416009
5-amino-2-(4-chloro-2-fluorophenoxy)pyridine-4-carboxamide
CID 114267919
2-chloro-6-(4-fluoro-3-methoxyphenoxy)pyrazine
CID 146289892
O-(4-chloro-2-fluorophenyl)hydroxylamine
CID 130505440
2-chloro-6-(2,4-difluorophenoxy)pyrido[3,4-d]pyrimidine
CID 11460591
N-[[6-(2,4-dichlorophenoxy)pyrazin-2-yl]methyl]propan-2-amine
CID 66450434

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine?
The IUPAC name of 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine (CID 174161630) is 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine.
What is the SMILES notation for 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine?
The canonical SMILES for 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine is C=Cc1cncc(Oc2ccc(Cl)cc2F)n1.
What is the InChIKey of 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine?
The InChIKey is SIULUGFAEXCCHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClFN2O/c1-2-9-6-15-7-12(16-9)17-11-4-3-8(13)5-10(11)14/h2-7H,1H2.
What are the key properties of 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine?
2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine has a molecular weight of 250.66 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-fluorophenoxy)-6-ethenylpyrazine is sourced from PubChem (CID 174161630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).