2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine

C10H4Cl3N3O3 — CID 62097953

IUPAC2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine
SMILESO=[N+]([O-])c1cc(Cl)c(Oc2cncc(Cl)n2)c(Cl)c1
InChIInChI=1S/C10H4Cl3N3O3/c11-6-1-5(16(17)18)2-7(12)10(6)19-9-4-14-3-8(13)15-9/h1-4H
InChIKeyOVDJMMCJINEHIM-UHFFFAOYSA-N
MW320.52 g/mol
LogP4.14
Rot. Bonds3

About 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine

2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine (PubChem CID 62097953) has the molecular formula C10H4Cl3N3O3 and a molecular weight of 320.52 g/mol. Its IUPAC name is 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine.

Molecular Properties

Compound Name2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine
PubChem CID62097953
Molecular FormulaC10H4Cl3N3O3
Molecular Weight320.52 g/mol
Exact Mass318.93
IUPAC Name2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine
SMILESO=[N+]([O-])c1cc(Cl)c(Oc2cncc(Cl)n2)c(Cl)c1
InChIInChI=1S/C10H4Cl3N3O3/c11-6-1-5(16(17)18)2-7(12)10(6)19-9-4-14-3-8(13)15-9/h1-4H
InChIKeyOVDJMMCJINEHIM-UHFFFAOYSA-N
XLogP4.14
TPSA78.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.52
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2,3,5-trichloro-6-(2,6-dichloro-4-nitrophenoxy)pyridine
CID 102749646
4-chloro-6-(2,6-dichloro-4-nitrophenoxy)-2-methylsulfanylpyrimidine
CID 80542312
2-chloro-6-(2-methoxy-4-nitrophenoxy)pyrazine
CID 62111115
6-(2,6-dichloro-4-nitrophenoxy)pyrimidine-2,4-diamine
CID 80873263
2-chloro-4-(2,6-dichloro-4-nitrophenoxy)-5-methylpyridine
CID 83269017
5-bromo-3-chloro-2-(2,6-dichloro-4-nitrophenoxy)pyridine
CID 103583685
1-[6-(2,6-dichloro-4-nitrophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 80637993
5-chloro-2-(2,6-dichloro-4-nitrophenoxy)-3-fluoropyridine
CID 79733335
2-chloro-6-(2,6-dibromo-4-nitrophenoxy)pyridine
CID 63587249
(2,6-dichloro-4-nitrophenyl) acetate
CID 53440733
4-(2,6-dichloro-4-nitrophenoxy)aniline
CID 106891919
methyl 6-(2-chloro-5-nitrophenoxy)pyrazine-2-carboxylate
CID 66457111

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine?
The IUPAC name of 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine (CID 62097953) is 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine.
What is the SMILES notation for 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine?
The canonical SMILES for 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine is O=[N+]([O-])c1cc(Cl)c(Oc2cncc(Cl)n2)c(Cl)c1.
What is the InChIKey of 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine?
The InChIKey is OVDJMMCJINEHIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H4Cl3N3O3/c11-6-1-5(16(17)18)2-7(12)10(6)19-9-4-14-3-8(13)15-9/h1-4H.
What are the key properties of 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine?
2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine has a molecular weight of 320.52 g/mol, XLogP of 4.14, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(2,6-dichloro-4-nitrophenoxy)pyrazine is sourced from PubChem (CID 62097953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).