6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride

C7H3Cl2F2NO2 — CID 130072799

IUPAC6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride
SMILESO=C(Cl)c1nc(Cl)cc(C(F)F)c1O
InChIInChI=1S/C7H3Cl2F2NO2/c8-3-1-2(7(10)11)5(13)4(12-3)6(9)14/h1,7,13H
InChIKeyUXTDOCWTBGZAHL-UHFFFAOYSA-N
MW242.01 g/mol
LogP2.76
Rot. Bonds2

About 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride

6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride (PubChem CID 130072799) has the molecular formula C7H3Cl2F2NO2 and a molecular weight of 242.01 g/mol. Its IUPAC name is 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride.

Molecular Properties

Compound Name6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride
PubChem CID130072799
Molecular FormulaC7H3Cl2F2NO2
Molecular Weight242.01 g/mol
Exact Mass240.95
IUPAC Name6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride
SMILESO=C(Cl)c1nc(Cl)cc(C(F)F)c1O
InChIInChI=1S/C7H3Cl2F2NO2/c8-3-1-2(7(10)11)5(13)4(12-3)6(9)14/h1,7,13H
InChIKeyUXTDOCWTBGZAHL-UHFFFAOYSA-N
XLogP2.76
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.01
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(difluoromethyl)-3-hydroxy-6-nitropyridine-2-carbonyl chloride
CID 118829446
4-amino-6-chloro-3-(difluoromethyl)pyridine-2-carbonyl chloride
CID 118799690
5-(difluoromethyl)-3-fluoro-6-iodopyridine-2-carbonyl chloride
CID 130080391
5-(difluoromethyl)-6-fluoro-3-hydroxypyridine-2-carbonyl chloride
CID 130079740
4-(difluoromethyl)-3-fluoro-6-iodopyridine-2-carbonyl chloride
CID 118828941
4-(difluoromethyl)-6-fluoro-3-iodopyridine-2-carbonyl chloride
CID 130080396
3-(difluoromethyl)-5-iodo-6-methylpyridine-2-carbonyl chloride
CID 130086377
4-(difluoromethyl)-3-iodo-6-methylpyridine-2-carbonyl chloride
CID 118829473
3-bromo-4-(difluoromethyl)-6-iodopyridine-2-carbonyl chloride
CID 130068522
4-bromo-5-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride
CID 118845560
4-chloro-3-(difluoromethyl)-6-iodopyridine-2-carbonyl chloride
CID 118845152
6-chloro-4-(difluoromethyl)-2-methylpyridine-3-carboxylic acid
CID 130074368

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride?
The IUPAC name of 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride (CID 130072799) is 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride.
What is the SMILES notation for 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride?
The canonical SMILES for 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride is O=C(Cl)c1nc(Cl)cc(C(F)F)c1O.
What is the InChIKey of 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride?
The InChIKey is UXTDOCWTBGZAHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3Cl2F2NO2/c8-3-1-2(7(10)11)5(13)4(12-3)6(9)14/h1,7,13H.
What are the key properties of 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride?
6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride has a molecular weight of 242.01 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride is sourced from PubChem (CID 130072799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).