5-chloro-2-hydroxybenzaldehyde

C7H5ClO2 — CID 12481

IUPAC5-chloro-2-hydroxybenzaldehyde
SMILESO=Cc1cc(Cl)ccc1O
InChIInChI=1S/C7H5ClO2/c8-6-1-2-7(10)5(3-6)4-9/h1-4,10H
InChIKeyFUGKCSRLAQKUHG-UHFFFAOYSA-N
MW156.57 g/mol
LogP1.86
Rot. Bonds1

About 5-chloro-2-hydroxybenzaldehyde

5-chloro-2-hydroxybenzaldehyde (PubChem CID 12481) has the molecular formula C7H5ClO2 and a molecular weight of 156.57 g/mol. Its IUPAC name is 5-chloro-2-hydroxybenzaldehyde.

Molecular Properties

Compound Name5-chloro-2-hydroxybenzaldehyde
PubChem CID12481
Molecular FormulaC7H5ClO2
Molecular Weight156.57 g/mol
Exact Mass156.00
IUPAC Name5-chloro-2-hydroxybenzaldehyde
SMILESO=Cc1cc(Cl)ccc1O
InChIInChI=1S/C7H5ClO2/c8-6-1-2-7(10)5(3-6)4-9/h1-4,10H
InChIKeyFUGKCSRLAQKUHG-UHFFFAOYSA-N
XLogP1.86
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.57
LogP ≤ 51.86
H-Bond Donors ≤ 51
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 5-chloro-2-hydroxybenzaldehyde?
The IUPAC name of 5-chloro-2-hydroxybenzaldehyde (CID 12481) is 5-chloro-2-hydroxybenzaldehyde.
What is the SMILES notation for 5-chloro-2-hydroxybenzaldehyde?
The canonical SMILES for 5-chloro-2-hydroxybenzaldehyde is O=Cc1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxybenzaldehyde?
The InChIKey is FUGKCSRLAQKUHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClO2/c8-6-1-2-7(10)5(3-6)4-9/h1-4,10H.
What are the key properties of 5-chloro-2-hydroxybenzaldehyde?
5-chloro-2-hydroxybenzaldehyde has a molecular weight of 156.57 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxybenzaldehyde is sourced from PubChem (CID 12481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).