4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine

C7H4Cl2F2IN — CID 130073192

IUPAC4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine
SMILESFC(F)c1cc(Cl)c(I)c(CCl)n1
InChIInChI=1S/C7H4Cl2F2IN/c8-2-5-6(12)3(9)1-4(13-5)7(10)11/h1,7H,2H2
InChIKeyZCQQHGLMQHONSO-UHFFFAOYSA-N
MW337.92 g/mol
LogP4.02
Rot. Bonds2

About 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine

4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine (PubChem CID 130073192) has the molecular formula C7H4Cl2F2IN and a molecular weight of 337.92 g/mol. Its IUPAC name is 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine.

Molecular Properties

Compound Name4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine
PubChem CID130073192
Molecular FormulaC7H4Cl2F2IN
Molecular Weight337.92 g/mol
Exact Mass336.87
IUPAC Name4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine
SMILESFC(F)c1cc(Cl)c(I)c(CCl)n1
InChIInChI=1S/C7H4Cl2F2IN/c8-2-5-6(12)3(9)1-4(13-5)7(10)11/h1,7H,2H2
InChIKeyZCQQHGLMQHONSO-UHFFFAOYSA-N
XLogP4.02
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.92
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2,4-dichloro-6-(difluoromethyl)-3-iodopyridine
CID 119020457
2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine-4-carbonitrile
CID 130077370
2-(chloromethyl)-6-(difluoromethyl)-3-iodo-4-nitropyridine
CID 118838108
[3-bromo-4-chloro-6-(difluoromethyl)-2-pyridinyl]methanamine
CID 118820044
2-(chloromethyl)-6-(difluoromethyl)-4-iodopyridine-3-carboxylic acid
CID 118854965
2-(bromomethyl)-4-chloro-6-(difluoromethyl)pyridin-3-amine
CID 130102673
6-(chloromethyl)-4-(difluoromethyl)-5-iodopyridin-2-amine
CID 130105343
2-(chloromethyl)-6-(difluoromethyl)-3-methylpyridin-4-amine
CID 130106396
[4-bromo-2-(chloromethyl)-6-(difluoromethyl)-3-pyridinyl]methanol
CID 130070605
2-[4-chloro-6-(difluoromethyl)-3-hydroxy-2-pyridinyl]acetonitrile
CID 118845077
4-(chloromethyl)-6-(difluoromethyl)-3-iodo-2-(trifluoromethyl)pyridine
CID 130087399
[6-(difluoromethyl)-3-fluoro-4-iodo-2-pyridinyl]methanamine
CID 118820195

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine?
The IUPAC name of 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine (CID 130073192) is 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine.
What is the SMILES notation for 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine?
The canonical SMILES for 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine is FC(F)c1cc(Cl)c(I)c(CCl)n1.
What is the InChIKey of 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine?
The InChIKey is ZCQQHGLMQHONSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4Cl2F2IN/c8-2-5-6(12)3(9)1-4(13-5)7(10)11/h1,7H,2H2.
What are the key properties of 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine?
4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine has a molecular weight of 337.92 g/mol, XLogP of 4.02, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(chloromethyl)-6-(difluoromethyl)-3-iodopyridine is sourced from PubChem (CID 130073192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).