Phenol, 3-isopropoxy-5-methyl-
TL;DR: Phenol, 3-isopropoxy-5-methyl- (CAS 959112-22-2) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-5-propan-2-yloxyphenol
Also Known As: Phenol, 3-isopropoxy-5-methyl-, 3-Isopropoxy-5-methylphenol, 3-methyl-5-propan-2-yloxyphenol, 3-Isopropoxy-5-methylphenol #, 3-METHYL-5-(PROPAN-2-YLOXY)PHENOL
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 959112-22-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OC(C)C)O |
| InChIKey | GDDUHIRACWGCID-UHFFFAOYSA-N |
Product Overview
Phenol, 3-isopropoxy-5-methyl- (CAS 959112-22-2), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: 3-methyl-5-propan-2-yloxyphenol.
Chemical Property Profile of Phenol, 3-isopropoxy-5-methyl-
Property Insights of Phenol, 3-isopropoxy-5-methyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 3-isopropoxy-5-methyl-. With a topological polar surface area (TPSA) of 29.5 Ų, Phenol, 3-isopropoxy-5-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 3-isopropoxy-5-methyl- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenol, 3-isopropoxy-5-methyl-?
The CAS number of Phenol, 3-isopropoxy-5-methyl- is 959112-22-2.
What is the molecular formula of Phenol, 3-isopropoxy-5-methyl-?
The molecular formula of Phenol, 3-isopropoxy-5-methyl- is C10H14O2.
What is the molecular weight of Phenol, 3-isopropoxy-5-methyl-?
The molecular weight of Phenol, 3-isopropoxy-5-methyl- is 166.10 g/mol.
Where can I buy Phenol, 3-isopropoxy-5-methyl-?
You can request a quote for Phenol, 3-isopropoxy-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 3-isopropoxy-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 3-isopropoxy-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.