3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine

C12H6Cl3F2NO — CID 133088180

IUPAC3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine
SMILESFC(F)Oc1c(Cl)cncc1-c1cccc(Cl)c1Cl
InChIInChI=1S/C12H6Cl3F2NO/c13-8-3-1-2-6(10(8)15)7-4-18-5-9(14)11(7)19-12(16)17/h1-5,12H
InChIKeyPRRHEPDIBVTTFT-UHFFFAOYSA-N
MW324.54 g/mol
LogP5.31
Rot. Bonds3

About 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine

3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine (PubChem CID 133088180) has the molecular formula C12H6Cl3F2NO and a molecular weight of 324.54 g/mol. Its IUPAC name is 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine.

Molecular Properties

Compound Name3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine
PubChem CID133088180
Molecular FormulaC12H6Cl3F2NO
Molecular Weight324.54 g/mol
Exact Mass322.95
IUPAC Name3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine
SMILESFC(F)Oc1c(Cl)cncc1-c1cccc(Cl)c1Cl
InChIInChI=1S/C12H6Cl3F2NO/c13-8-3-1-2-6(10(8)15)7-4-18-5-9(14)11(7)19-12(16)17/h1-5,12H
InChIKeyPRRHEPDIBVTTFT-UHFFFAOYSA-N
XLogP5.31
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.54
LogP ≤ 55.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,3-trichloro-4-[3-chloro-2-(difluoromethoxy)phenyl]benzene
CID 118849408
3,5-bis(2,3-dichlorophenyl)-4-fluoropyridine
CID 133090739
1,2,3-trichloro-4-[2-(difluoromethoxy)-3-fluorophenyl]benzene
CID 118826152
1,2-dichloro-3-[5-chloro-2-(difluoromethoxy)phenyl]benzene
CID 134629574
4-chloro-3-(2,3-dichlorophenyl)pyridine
CID 118828416
1,2,3-trichloro-4-[2-chloro-3-(difluoromethoxy)phenyl]benzene
CID 134622361
3-chloro-5-(2,3-difluorophenyl)-4-methoxypyridine
CID 133087903
1,2-dichloro-3-[4-chloro-3-(difluoromethoxy)phenyl]benzene
CID 118822247
1,3-dichloro-2-[2-chloro-3-(difluoromethoxy)phenyl]benzene
CID 119010912
2-(2,3-dichlorophenyl)-3-(difluoromethoxy)-6-(trifluoromethyl)pyridine
CID 118830631
2-(2,3-dichlorophenyl)-6-methoxypyrazine
CID 160525380
3-(2,3-dichlorophenyl)-5-fluoropyridine
CID 133090720

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine?
The IUPAC name of 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine (CID 133088180) is 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine.
What is the SMILES notation for 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine?
The canonical SMILES for 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine is FC(F)Oc1c(Cl)cncc1-c1cccc(Cl)c1Cl.
What is the InChIKey of 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine?
The InChIKey is PRRHEPDIBVTTFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl3F2NO/c13-8-3-1-2-6(10(8)15)7-4-18-5-9(14)11(7)19-12(16)17/h1-5,12H.
What are the key properties of 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine?
3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine has a molecular weight of 324.54 g/mol, XLogP of 5.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(2,3-dichlorophenyl)-4-(difluoromethoxy)pyridine is sourced from PubChem (CID 133088180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).