2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine

C12H7Cl4NO — CID 119013717

IUPAC2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine
SMILESCOc1cc(-c2ccc(Cl)c(Cl)c2Cl)cc(Cl)n1
InChIInChI=1S/C12H7Cl4NO/c1-18-10-5-6(4-9(14)17-10)7-2-3-8(13)12(16)11(7)15/h2-5H,1H3
InChIKeyDPZBMTDYOSMJQU-UHFFFAOYSA-N
MW323.01 g/mol
LogP5.37
Rot. Bonds2

About 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine

2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine (PubChem CID 119013717) has the molecular formula C12H7Cl4NO and a molecular weight of 323.01 g/mol. Its IUPAC name is 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine.

Molecular Properties

Compound Name2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine
PubChem CID119013717
Molecular FormulaC12H7Cl4NO
Molecular Weight323.01 g/mol
Exact Mass320.93
IUPAC Name2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine
SMILESCOc1cc(-c2ccc(Cl)c(Cl)c2Cl)cc(Cl)n1
InChIInChI=1S/C12H7Cl4NO/c1-18-10-5-6(4-9(14)17-10)7-2-3-8(13)12(16)11(7)15/h2-5H,1H3
InChIKeyDPZBMTDYOSMJQU-UHFFFAOYSA-N
XLogP5.37
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.01
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-chloro-6-methoxy-4-[2-(trifluoromethyl)phenyl]pyridine
CID 119004606
2-chloro-4-(4-isocyanophenyl)-6-methoxypyridine
CID 140744754
2,4-dichloro-6-methoxypyridine
CID 59872472
2,6-dichloro-3-(2,3,4-trichlorophenyl)pyridine
CID 118997066
5-chloro-2-methoxy-3-(2,3,4-trichlorophenyl)pyridine
CID 134635987
methyl 2-methoxy-5-(2,3,4-trichlorophenyl)pyridine-4-carboxylate
CID 134636667
sodium;4-chloro-6-methoxypyrimidin-2-amine;hydride
CID 175737665
4-(2,4-dichlorophenyl)-6-methoxypyrimidin-2-amine
CID 39826310
2-chloro-6-methoxypyridine-4-carbonitrile;2,6-dichloropyridine-4-carbonitrile
CID 159564472
6-methoxy-5-(2,3,4-trichlorophenyl)pyridine-2-carboxylic acid
CID 134636463
[3-chloro-5-(2,3,4-trichlorophenyl)-2-pyridinyl]methanol
CID 134636116
2-fluoro-6-methoxy-4-(2,3,4,5,6-pentachlorophenyl)pyridine
CID 133089961

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine?
The IUPAC name of 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine (CID 119013717) is 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine.
What is the SMILES notation for 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine?
The canonical SMILES for 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine is COc1cc(-c2ccc(Cl)c(Cl)c2Cl)cc(Cl)n1.
What is the InChIKey of 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine?
The InChIKey is DPZBMTDYOSMJQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl4NO/c1-18-10-5-6(4-9(14)17-10)7-2-3-8(13)12(16)11(7)15/h2-5H,1H3.
What are the key properties of 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine?
2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine has a molecular weight of 323.01 g/mol, XLogP of 5.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methoxy-4-(2,3,4-trichlorophenyl)pyridine is sourced from PubChem (CID 119013717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).