4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde

C7H4ClF2NO2 — CID 130970189

IUPAC4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde
SMILESO=Cc1cc(Cl)c(OC(F)F)cn1
InChIInChI=1S/C7H4ClF2NO2/c8-5-1-4(3-12)11-2-6(5)13-7(9)10/h1-3,7H
InChIKeyQFQZCBRODZFHPX-UHFFFAOYSA-N
MW207.56 g/mol
LogP2.15
Rot. Bonds3

About 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde

4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde (PubChem CID 130970189) has the molecular formula C7H4ClF2NO2 and a molecular weight of 207.56 g/mol. Its IUPAC name is 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde.

Molecular Properties

Compound Name4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde
PubChem CID130970189
Molecular FormulaC7H4ClF2NO2
Molecular Weight207.56 g/mol
Exact Mass206.99
IUPAC Name4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde
SMILESO=Cc1cc(Cl)c(OC(F)F)cn1
InChIInChI=1S/C7H4ClF2NO2/c8-5-1-4(3-12)11-2-6(5)13-7(9)10/h1-3,7H
InChIKeyQFQZCBRODZFHPX-UHFFFAOYSA-N
XLogP2.15
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.56
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-5-(difluoromethoxy)pyridine-4-carbaldehyde
CID 131167977
3-(difluoromethoxy)-5-methylpyridine-2-carbaldehyde
CID 174808071
4-chloro-5-(difluoromethoxy)-2-methylbenzaldehyde
CID 171004500
2-chloro-5-(difluoromethoxy)pyridine-3-carbaldehyde
CID 119008832
4-chloro-5-(difluoromethoxy)pyrimidin-2-amine
CID 139615026
2,3-dichloro-6-(difluoromethoxy)benzaldehyde
CID 121228172
4-chloro-3-(difluoromethoxy)pyridine-2-carbaldehyde
CID 130779479
5-(chloromethyl)-4-(difluoromethyl)pyridine-2-carbaldehyde
CID 130098388
4-chloro-2-(difluoromethoxy)pyridine-3-carbaldehyde
CID 118839602
4,5-dimethoxypyridine-2-carbaldehyde;propane
CID 143811555
5-chloro-6-(difluoromethoxy)-1H-indazole
CID 171662371
3-(difluoromethoxy)-2,5-dimethylbenzaldehyde
CID 131524669

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde?
The IUPAC name of 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde (CID 130970189) is 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde.
What is the SMILES notation for 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde?
The canonical SMILES for 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde is O=Cc1cc(Cl)c(OC(F)F)cn1.
What is the InChIKey of 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde?
The InChIKey is QFQZCBRODZFHPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClF2NO2/c8-5-1-4(3-12)11-2-6(5)13-7(9)10/h1-3,7H.
What are the key properties of 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde?
4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde has a molecular weight of 207.56 g/mol, XLogP of 2.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-(difluoromethoxy)pyridine-2-carbaldehyde is sourced from PubChem (CID 130970189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).