Products for Research Use Only
RegisterLogin

Chlorothymol

CAT: 0804-HY-B1606-01Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-B1606-01Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Chlothymol is a potent positive modulator of the GABAA receptor subunit LGC-37, anticonvulsant, and antibacterial agent. Chlothymol inhibits Pentylenetetrazol-induced c-fos expression. Chlothymol inhibits the growth of Methicillin -resistant Staphylococcus aureus (MRSA) strains, including LAC, with an MIC of 32 μg/mL. Chlorothymol has protective effects against epileptic seizures in various mouse models[1][2].
CAS Number
89-68-9
Product Name Alternative
Chlorthymol; 6-Chlorothymol
UNSPSC
12352005
Hazard Statement
H315, H319, H335
Target
AP-1; Bacterial; GABA Receptor
Type
Reference compound
Related Pathways
Anti-infection; Immunology/Inflammation; Membrane Transporter/Ion Channel; Neuronal Signaling
Applications
Neuroscience-Neuromodulation
Field of Research
Infection; Neurological Disease
Assay Protocol
https://www.medchemexpress.com/chlorothymol.html
Purity
99.70
Solubility
DMSO : ≥ 100 mg/mL
Smiles
CC(C1=C(O)C=C(C)C(Cl)=C1)C
Molecular Formula
C10H13ClO
Molecular Weight
184.67
Precautions
H315, H319, H335
References & Citations
[1]Alistair Jones, et al. A multiorganism pipeline for antiseizure drug discovery: Identification of chlorothymol as a novel γ-aminobutyric acidergic anticonvulsant. Epilepsia. 2020 Oct;61 (10) :2106-2118. |[2]Kim BC, et al. 4-Chloro-2-Isopropyl-5-Methylphenol Exhibits Antimicrobial and Adjuvant Activity against Methicillin-Resistant Staphylococcus aureus. J Microbiol Biotechnol. 2022 Jun 28;32 (6) :730-739.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, stored under nitrogen)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Chlorothymol

The CIR Expert panel concludes Sodium p-Chloro-m-Cresol, p-Chloro-m-Cresol, Chlorothymol, m-Cresol, o-Cresol, Isopropyl Cresols, Thymol, o-Cymen-5-ol, Cavacrol are safe at concentrations up to 0.5% in cosmetics; however, the available data are insufficient to support the safety of p-Cresol and Mixed Cresols for use in cosmetic products.

CAS Number89-68-9
PubChem CID6982
IUPAC Name4-chloro-5-methyl-2-propan-2-ylphenol
Molecular FormulaC10H13ClO
Molecular Weight184.66
XLogP3.9
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity147
SMILES
CC1=CC(=C(C=C1Cl)C(C)C)O
InChI
InChI=1S/C10H13ClO/c1-6(2)8-5-9(11)7(3)4-10(8)12/h4-6,12H,1-3H3
InChIKey
KFZXVMNBUMVKLN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Chlorothymol
CAS: 89-68-9
CID: 6982
Formula: C10H13ClO
MW: 184.66
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight184.66
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass184.0654927
Monoisotopic Mass184.0654927
Topological Polar Surface Area20.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity147
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA1581-100Chlorothymol
C19540-016-Chlorothymol
FC70467-01(4) 6-Chlorothymol

Popular Products