o-Cymen-5-ol
Star0
This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Identification
- Generic Name
- o-Cymen-5-ol
- DrugBank Accession Number
- DB15901
- Background
Not Available
- Type
- Small Molecule
- Groups
- Experimental
- Structure
- Weight
- Average: 150.221
Monoisotopic: 150.104465071 - Chemical Formula
- C10H14O
- Synonyms
- 4-Isopropyl-3-methylphenol
- 4-Isopropyl-m-cresol
- o-Cymen-5-ol
- o-Cymen-5y-ol
- p-Thymol
Pharmacology
- Indication
Not Available
Reduce drug development failure ratesBuild, train, & validate machine-learning modelswith evidence-based and structured datasets.Build, train, & validate predictive machine-learning models with structured datasets.- Contraindications & Blackbox Warnings
- Prevent Adverse Drug Events TodayTap into our Clinical API for life-saving information on contraindications & blackbox warnings, population restrictions, harmful risks, & more.Avoid life-threatening adverse drug events with our Clinical API
- Pharmacodynamics
Not Available
- Mechanism of action
- Not Available
- Absorption
Not Available
- Volume of distribution
Not Available
- Protein binding
Not Available
- Metabolism
- Not Available
- Route of elimination
Not Available
- Half-life
Not Available
- Clearance
Not Available
- Adverse Effects
- Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.
- Toxicity
Not Available
- Pathways
- Not Available
- Pharmacogenomic Effects/ADRs
- Not Available
Interactions
- Drug Interactions
- This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.Not Available
- Food Interactions
- Not Available
Products
- Drug product information from 10+ global regionsOur datasets provide approved product information including:dosage, form, labeller, route of administration, and marketing period.Access drug product information from over 10 global regions.
- International/Other Brands
- Biosol / Frecide
- Over the Counter Products
Name Dosage Strength Route Labeller Marketing Start Marketing End Region Image NORO-X Foaming HandSoap Soap 0.095 g/100mL Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US NORO-X Foaming HandSoap Soap 0.095 g/100mL Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US NORO-X Foaming HandSoap Soap 0.095 g/100mL Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US NORO-X Foaming HandSoap Soap 0.095 g/100mL Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US NORO-X Forming HandSoap Soap 0.095 g/100mL Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US - Mixture Products
Name Ingredients Dosage Route Labeller Marketing Start Marketing End Region Image Be Clean o-Cymen-5-ol (0.085 mg/100mg) + Thymol (1.35 mg/100mg) Liquid Topical CLEANFORCE LLC 2020-10-12 Not applicable US - Unapproved/Other Products
Name Ingredients Dosage Route Labeller Marketing Start Marketing End Region Image NORO-X Foaming HandSoap o-Cymen-5-ol (0.095 g/100mL) Soap Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US NORO-X Foaming HandSoap o-Cymen-5-ol (0.095 g/100mL) Soap Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US NORO-X Foaming HandSoap o-Cymen-5-ol (0.095 g/100mL) Soap Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US NORO-X Foaming HandSoap o-Cymen-5-ol (0.095 g/100mL) Soap Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US NORO-X Forming HandSoap o-Cymen-5-ol (0.095 g/100mL) Soap Topical BIO3S Co.,Ltd. 2022-12-27 Not applicable US
Categories
- Drug Categories
- Classification
- Not classified
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- H41B6Q1I9L
- CAS number
- 3228-02-2
- InChI Key
- IJALWSVNUBBQRA-UHFFFAOYSA-N
- InChI
- InChI=1S/C10H14O/c1-7(2)10-5-4-9(11)6-8(10)3/h4-7,11H,1-3H3
- IUPAC Name
- 3-methyl-4-(propan-2-yl)phenol
- SMILES
- CC(C)C1=CC=C(O)C=C1C
References
- General References
- Not Available
- External Links
- KEGG Compound
- C14741
- ChemSpider
- 17564
- 1364387
- ChEBI
- 34429
- ZINC
- ZINC000001691011
Clinical Trials
Pharmacoeconomics
- Manufacturers
- Not Available
- Packagers
- Not Available
- Dosage Forms
Form Route Strength Liquid Topical Soap Topical 0.095 g/100mL - Prices
- Not Available
- Patents
- Not Available
Properties
- State
- Not Available
- Experimental Properties
- Not Available
- Predicted Properties
Property Value Source logP 3.43 Chemaxon pKa (Strongest Acidic) 10.39 Chemaxon pKa (Strongest Basic) -5.4 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 1 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 20.23 Å2 Chemaxon Rotatable Bond Count 1 Chemaxon Refractivity 47.27 m3·mol-1 Chemaxon Polarizability 17.75 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon - Predicted ADMET Features
- Not Available
Spectra
- Mass Spec (NIST)
- Not Available
- Spectra
Spectrum Spectrum Type Splash Key Predicted MS/MS Spectrum - 10V, Positive (Annotated) Predicted LC-MS/MS splash10-0f6x-6900000000-88b2950331a98727d7d0 Predicted MS/MS Spectrum - 10V, Negative (Annotated) Predicted LC-MS/MS splash10-0002-0900000000-3d7332fa5fa0d8def919 Predicted MS/MS Spectrum - 20V, Positive (Annotated) Predicted LC-MS/MS splash10-0006-9300000000-270469b4c95d377c01b9 Predicted MS/MS Spectrum - 20V, Negative (Annotated) Predicted LC-MS/MS splash10-0002-0900000000-748be2880b93f9914d1d Predicted MS/MS Spectrum - 40V, Positive (Annotated) Predicted LC-MS/MS splash10-0006-9100000000-5b35eee8c986a931fbd3 Predicted MS/MS Spectrum - 40V, Negative (Annotated) Predicted LC-MS/MS splash10-0a4l-7900000000-aaf576cd3af0a20bf307 Predicted 1H NMR Spectrum 1D NMR Not Applicable Predicted 13C NMR Spectrum 1D NMR Not Applicable - Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 137.3478015 predictedDarkChem Lite v0.1.0 [M-H]- 136.18163 predictedDeepCCS 1.0 (2019) [M+H]+ 138.1258015 predictedDarkChem Lite v0.1.0 [M+H]+ 139.69992 predictedDeepCCS 1.0 (2019) [M+Na]+ 137.5003015 predictedDarkChem Lite v0.1.0 [M+Na]+ 149.18968 predictedDeepCCS 1.0 (2019)
Drug created at October 26, 2020 15:10 / Updated at October 27, 2020 21:12