7-chloro-6-fluoroquinoline-2-carbaldehyde

C10H5ClFNO — CID 23359173

IUPAC7-chloro-6-fluoroquinoline-2-carbaldehyde
SMILESO=Cc1ccc2cc(F)c(Cl)cc2n1
InChIInChI=1S/C10H5ClFNO/c11-8-4-10-6(3-9(8)12)1-2-7(5-14)13-10/h1-5H
InChIKeyAQYFLYVSNVPCPO-UHFFFAOYSA-N
MW209.61 g/mol
LogP2.84
Rot. Bonds1

About 7-chloro-6-fluoroquinoline-2-carbaldehyde

7-chloro-6-fluoroquinoline-2-carbaldehyde (PubChem CID 23359173) has the molecular formula C10H5ClFNO and a molecular weight of 209.61 g/mol. Its IUPAC name is 7-chloro-6-fluoroquinoline-2-carbaldehyde.

Molecular Properties

Compound Name7-chloro-6-fluoroquinoline-2-carbaldehyde
PubChem CID23359173
Molecular FormulaC10H5ClFNO
Molecular Weight209.61 g/mol
Exact Mass209.00
IUPAC Name7-chloro-6-fluoroquinoline-2-carbaldehyde
SMILESO=Cc1ccc2cc(F)c(Cl)cc2n1
InChIInChI=1S/C10H5ClFNO/c11-8-4-10-6(3-9(8)12)1-2-7(5-14)13-10/h1-5H
InChIKeyAQYFLYVSNVPCPO-UHFFFAOYSA-N
XLogP2.84
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.61
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-6-fluoroquinoline-2-carbaldehyde?
The IUPAC name of 7-chloro-6-fluoroquinoline-2-carbaldehyde (CID 23359173) is 7-chloro-6-fluoroquinoline-2-carbaldehyde.
What is the SMILES notation for 7-chloro-6-fluoroquinoline-2-carbaldehyde?
The canonical SMILES for 7-chloro-6-fluoroquinoline-2-carbaldehyde is O=Cc1ccc2cc(F)c(Cl)cc2n1.
What is the InChIKey of 7-chloro-6-fluoroquinoline-2-carbaldehyde?
The InChIKey is AQYFLYVSNVPCPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5ClFNO/c11-8-4-10-6(3-9(8)12)1-2-7(5-14)13-10/h1-5H.
What are the key properties of 7-chloro-6-fluoroquinoline-2-carbaldehyde?
7-chloro-6-fluoroquinoline-2-carbaldehyde has a molecular weight of 209.61 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-6-fluoroquinoline-2-carbaldehyde is sourced from PubChem (CID 23359173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).